4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid

C18H19N5O4 — CID 137352642

IUPAC4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid
SMILESNC(=O)c1ccnc(-c2ccc(NC(=O)C3CCN(C(=O)O)CC3)cn2)c1
InChIInChI=1S/C18H19N5O4/c19-16(24)12-3-6-20-15(9-12)14-2-1-13(10-21-14)22-17(25)11-4-7-23(8-5-11)18(26)27/h1-3,6,9-11H,4-5,7-8H2,(H2,19,24)(H,22,25)(H,26,27)
InChIKeyUEPZKENKFARCKM-UHFFFAOYSA-N
MW369.38 g/mol
LogP1.57
Rot. Bonds4

About 4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid

4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid (PubChem CID 137352642) has the molecular formula C18H19N5O4 and a molecular weight of 369.38 g/mol. Its IUPAC name is 4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid.

Molecular Properties

Compound Name4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid
PubChem CID137352642
Molecular FormulaC18H19N5O4
Molecular Weight369.38 g/mol
Exact Mass369.14
IUPAC Name4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid
SMILESNC(=O)c1ccnc(-c2ccc(NC(=O)C3CCN(C(=O)O)CC3)cn2)c1
InChIInChI=1S/C18H19N5O4/c19-16(24)12-3-6-20-15(9-12)14-2-1-13(10-21-14)22-17(25)11-4-7-23(8-5-11)18(26)27/h1-3,6,9-11H,4-5,7-8H2,(H2,19,24)(H,22,25)(H,26,27)
InChIKeyUEPZKENKFARCKM-UHFFFAOYSA-N
XLogP1.57
TPSA138.51 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.38
LogP ≤ 51.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[5-(piperidine-4-carbonylamino)-2-pyridinyl]pyridine-4-carboxamide
CID 137352117
N-(6-amino-3-pyridinyl)-1-benzoylpiperidine-4-carboxamide;hydrochloride
CID 119516000
(3S)-3-[(6-carbamoylisoquinolin-3-yl)carbamoyl]pyrrolidine-1-carboxylic acid
CID 118980630
4-[(4-chlorophenyl)carbamoyl]piperidine-1-carboxylic acid
CID 66651371
3-[(1-benzoylpiperidine-4-carbonyl)amino]benzoic acid
CID 119219598
methyl 4-[(4-carbamoylphenyl)carbamoyl]piperidine-1-carboxylate
CID 110754209
1-(3-fluorobenzoyl)-N-pyridin-3-ylpiperidine-4-carboxamide
CID 17223654
N-(4-carbamoylphenyl)-1-(3,4,5-trimethoxybenzoyl)piperidine-4-carboxamide
CID 126029026
N-(6-amino-3-pyridinyl)-1-benzoylpiperidine-3-carboxamide
CID 119516397
2-[3-[(1-benzoylpiperidine-4-carbonyl)amino]phenoxy]acetic acid
CID 119224819
4-[(1-benzoylpiperidine-4-carbonyl)amino]benzoic acid
CID 119177742
N-[3-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]phenyl]cyclopropanecarboxamide
CID 31611202

Frequently Asked Questions

What is the IUPAC name of 4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid?
The IUPAC name of 4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid (CID 137352642) is 4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid.
What is the SMILES notation for 4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid?
The canonical SMILES for 4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid is NC(=O)c1ccnc(-c2ccc(NC(=O)C3CCN(C(=O)O)CC3)cn2)c1.
What is the InChIKey of 4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid?
The InChIKey is UEPZKENKFARCKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O4/c19-16(24)12-3-6-20-15(9-12)14-2-1-13(10-21-14)22-17(25)11-4-7-23(8-5-11)18(26)27/h1-3,6,9-11H,4-5,7-8H2,(H2,19,24)(H,22,25)(H,26,27).
What are the key properties of 4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid?
4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid has a molecular weight of 369.38 g/mol, XLogP of 1.57, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[6-(4-carbamoyl-2-pyridinyl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid is sourced from PubChem (CID 137352642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).