7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide

C15H20N4O — CID 175939650

IUPAC7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
SMILESCC1CCCCN1Cc1cc(C(N)=O)nc2cc[nH]c12
InChIInChI=1S/C15H20N4O/c1-10-4-2-3-7-19(10)9-11-8-13(15(16)20)18-12-5-6-17-14(11)12/h5-6,8,10,17H,2-4,7,9H2,1H3,(H2,16,20)
InChIKeyBLKHSMFUXPWIFJ-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.04
Rot. Bonds3

About 7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide

7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide (PubChem CID 175939650) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide.

Molecular Properties

Compound Name7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
PubChem CID175939650
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
SMILESCC1CCCCN1Cc1cc(C(N)=O)nc2cc[nH]c12
InChIInChI=1S/C15H20N4O/c1-10-4-2-3-7-19(10)9-11-8-13(15(16)20)18-12-5-6-17-14(11)12/h5-6,8,10,17H,2-4,7,9H2,1H3,(H2,16,20)
InChIKeyBLKHSMFUXPWIFJ-UHFFFAOYSA-N
XLogP2.04
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

7-[(3-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide
CID 175929813
N-[[2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]quinoxaline-2-carboxamide
CID 55718070
4-bromo-3-[(2-methylpiperidin-1-yl)methyl]benzoic acid
CID 165458505
5-[(2-methylpiperidin-1-yl)methyl]-1,2-oxazole-3-carboxylic acid
CID 61397908
3-chloro-4-[(2-methylpiperidin-1-yl)methyl]benzoic acid;hydrochloride
CID 166594028
4-acetyl-N-[[2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]-1H-pyrrole-2-carboxamide
CID 46478370
[4-[(2-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
CID 63888634
N-methyl-3-[(2-methylpiperidin-1-yl)methyl]quinolin-2-amine
CID 62178927
2-[(2-methylpiperidin-1-yl)methyl]pyridine-3-carboxylic acid
CID 82187666
1-[2-[(2-methylpiperidin-1-yl)methyl]-1,3-thiazol-4-yl]ethanone
CID 82515560
5-ethyl-N-[[2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]-1H-pyrazole-3-carboxamide
CID 78875791
1-(2-amino-2-oxoethyl)-N-[[2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]triazole-4-carboxamide
CID 126771493

Frequently Asked Questions

What is the IUPAC name of 7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide?
The IUPAC name of 7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide (CID 175939650) is 7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide.
What is the SMILES notation for 7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide?
The canonical SMILES for 7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide is CC1CCCCN1Cc1cc(C(N)=O)nc2cc[nH]c12.
What is the InChIKey of 7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide?
The InChIKey is BLKHSMFUXPWIFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-10-4-2-3-7-19(10)9-11-8-13(15(16)20)18-12-5-6-17-14(11)12/h5-6,8,10,17H,2-4,7,9H2,1H3,(H2,16,20).
What are the key properties of 7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide?
7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 2.04, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(2-methylpiperidin-1-yl)methyl]-1H-pyrrolo[3,2-b]pyridine-5-carboxamide is sourced from PubChem (CID 175939650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).