4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide

C20H31N5O2 — CID 87003345

IUPAC4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide
SMILESCN(C)C(=O)C1CCN(C(=O)NCc2ccnc(N3CCCCC3)c2)CC1
InChIInChI=1S/C20H31N5O2/c1-23(2)19(26)17-7-12-25(13-8-17)20(27)22-15-16-6-9-21-18(14-16)24-10-4-3-5-11-24/h6,9,14,17H,3-5,7-8,10-13,15H2,1-2H3,(H,22,27)
InChIKeyBUKTVMKRQHRBGH-UHFFFAOYSA-N
MW373.50 g/mol
LogP2.08
Rot. Bonds4

About 4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide

4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide (PubChem CID 87003345) has the molecular formula C20H31N5O2 and a molecular weight of 373.50 g/mol. Its IUPAC name is 4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide
PubChem CID87003345
Molecular FormulaC20H31N5O2
Molecular Weight373.50 g/mol
Exact Mass373.25
IUPAC Name4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide
SMILESCN(C)C(=O)C1CCN(C(=O)NCc2ccnc(N3CCCCC3)c2)CC1
InChIInChI=1S/C20H31N5O2/c1-23(2)19(26)17-7-12-25(13-8-17)20(27)22-15-16-6-9-21-18(14-16)24-10-4-3-5-11-24/h6,9,14,17H,3-5,7-8,10-13,15H2,1-2H3,(H,22,27)
InChIKeyBUKTVMKRQHRBGH-UHFFFAOYSA-N
XLogP2.08
TPSA68.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.50
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-N,4-N-dimethyl-1-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide
CID 87004175
4-(4-methylbenzoyl)-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1-carboxamide
CID 55913038
4-(azepan-1-ylmethyl)-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1-carboxamide
CID 55793525
N-[[2-(azepan-1-yl)-4-pyridinyl]methyl]-4-(morpholin-4-ylmethyl)piperidine-1-carboxamide
CID 86898946
4-methyl-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]piperazine-1-carboxamide
CID 155944201
N-[[2-(azepan-1-yl)-4-pyridinyl]methyl]-2-methyl-6-phenylmorpholine-4-carboxamide
CID 86898973
N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide
CID 55742798
2-(hydroxymethyl)-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]pyrrolidine-1-carboxamide
CID 111427840
4-(4-methoxyphenyl)-N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]piperazine-1-carboxamide
CID 55589473
4-N-[3-(diethylamino)propyl]-1-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide
CID 55794635
methyl 4-[(2-pyrrolidin-1-yl-4-pyridinyl)methylcarbamoyl]morpholine-2-carboxylate
CID 136523588
N-[[2-(azepan-1-yl)-4-pyridinyl]methyl]-N'-methyl-4-(morpholine-4-carbonyl)piperidine-1-carboximidamide
CID 111984605

Frequently Asked Questions

What is the IUPAC name of 4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide?
The IUPAC name of 4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide (CID 87003345) is 4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide.
What is the SMILES notation for 4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide?
The canonical SMILES for 4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide is CN(C)C(=O)C1CCN(C(=O)NCc2ccnc(N3CCCCC3)c2)CC1.
What is the InChIKey of 4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide?
The InChIKey is BUKTVMKRQHRBGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N5O2/c1-23(2)19(26)17-7-12-25(13-8-17)20(27)22-15-16-6-9-21-18(14-16)24-10-4-3-5-11-24/h6,9,14,17H,3-5,7-8,10-13,15H2,1-2H3,(H,22,27).
What are the key properties of 4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide?
4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide has a molecular weight of 373.50 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N-dimethyl-1-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]piperidine-1,4-dicarboxamide is sourced from PubChem (CID 87003345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).