N,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide

C19H23N7O — CID 175524245

IUPACN,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide
SMILESCN(C)C(=O)c1cc2cnc(Nc3ccc(C4CCNCC4)cn3)nc2[nH]1
InChIInChI=1S/C19H23N7O/c1-26(2)18(27)15-9-14-11-22-19(25-17(14)23-15)24-16-4-3-13(10-21-16)12-5-7-20-8-6-12/h3-4,9-12,20H,5-8H2,1-2H3,(H2,21,22,23,24,25)
InChIKeyWIZBPRREOKHQJB-UHFFFAOYSA-N
MW365.44 g/mol
LogP2.27
Rot. Bonds4

About N,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide

N,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide (PubChem CID 175524245) has the molecular formula C19H23N7O and a molecular weight of 365.44 g/mol. Its IUPAC name is N,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide
PubChem CID175524245
Molecular FormulaC19H23N7O
Molecular Weight365.44 g/mol
Exact Mass365.20
IUPAC NameN,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide
SMILESCN(C)C(=O)c1cc2cnc(Nc3ccc(C4CCNCC4)cn3)nc2[nH]1
InChIInChI=1S/C19H23N7O/c1-26(2)18(27)15-9-14-11-22-19(25-17(14)23-15)24-16-4-3-13(10-21-16)12-5-7-20-8-6-12/h3-4,9-12,20H,5-8H2,1-2H3,(H2,21,22,23,24,25)
InChIKeyWIZBPRREOKHQJB-UHFFFAOYSA-N
XLogP2.27
TPSA98.83 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 52.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze N,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide with MolForge

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Related Compounds

7-cyclopentyl-6-methylsulfinyl-N-(5-piperidin-4-yl-2-pyridinyl)pyrrolo[2,3-d]pyrimidin-2-amine
CID 137445687
4-cyclopentyl-N,N-dimethyl-2-[(5-sulfamoyl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide
CID 175715255
N,N,2-trimethyl-4-piperidin-4-ylbenzamide;hydrochloride
CID 169452615
N,N-dimethyl-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide
CID 67251691
N-(5-piperidin-4-yl-2-pyridinyl)-1-propan-2-yltriazolo[4,5-h]quinazolin-8-amine;hydrochloride
CID 167640890
6-acetyl-8-cyclohexyl-5-methyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]pyrido[2,3-d]pyrimidin-7-one
CID 166879305
7-cyclopentyl-N,N-dimethyl-2-[[5-(1-oxo-2,9-diazaspiro[5.5]undecan-2-yl)-2-pyridinyl]amino]pyrrolo[2,3-d]pyrimidine-6-carboxamide
CID 67355422
8-cyclopentyl-5-methyl-7-methylidene-N-(5-piperidin-4-yl-2-pyridinyl)-6-prop-1-en-2-ylpyrido[2,3-d]pyrimidin-2-amine
CID 155036428
7-cyclopentyl-2-[[5-[1-[2-[4-[3-(2,6-dioxopiperidin-3-yl)phenyl]piperazin-1-yl]ethyl]piperidin-4-yl]-2-pyridinyl]amino]-N,N-dimethylpyrrolo[2,3-d]pyrimidine-6-carboxamide
CID 170378193
7-cyclopentyl-N,N-dimethyl-2-[[5-(3-methylpiperazin-1-yl)-2-pyridinyl]amino]pyrrolo[2,3-d]pyrimidine-6-carboxamide
CID 44818402
7-cyclopentyl-N,N-dimethyl-2-[[5-(piperazin-1-ylmethyl)-2-pyridinyl]amino]thieno[3,2-d]pyrimidine-6-carboxamide
CID 118553468
N,N-dimethyl-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
CID 122648492

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide?
The IUPAC name of N,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide (CID 175524245) is N,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide.
What is the SMILES notation for N,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide?
The canonical SMILES for N,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide is CN(C)C(=O)c1cc2cnc(Nc3ccc(C4CCNCC4)cn3)nc2[nH]1.
What is the InChIKey of N,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide?
The InChIKey is WIZBPRREOKHQJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N7O/c1-26(2)18(27)15-9-14-11-22-19(25-17(14)23-15)24-16-4-3-13(10-21-16)12-5-7-20-8-6-12/h3-4,9-12,20H,5-8H2,1-2H3,(H2,21,22,23,24,25).
What are the key properties of N,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide?
N,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide has a molecular weight of 365.44 g/mol, XLogP of 2.27, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(5-piperidin-4-yl-2-pyridinyl)amino]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide is sourced from PubChem (CID 175524245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).