N-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide

C18H27N5O — CID 126889961

IUPACN-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide
SMILESO=C(NC1CCCC1)N1CCC(N(c2ccncn2)C2CC2)CC1
InChIInChI=1S/C18H27N5O/c24-18(21-14-3-1-2-4-14)22-11-8-16(9-12-22)23(15-5-6-15)17-7-10-19-13-20-17/h7,10,13-16H,1-6,8-9,11-12H2,(H,21,24)
InChIKeySNUBTISDYRKGEZ-UHFFFAOYSA-N
MW329.45 g/mol
LogP2.56
Rot. Bonds4

About N-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide

N-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide (PubChem CID 126889961) has the molecular formula C18H27N5O and a molecular weight of 329.45 g/mol. Its IUPAC name is N-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide
PubChem CID126889961
Molecular FormulaC18H27N5O
Molecular Weight329.45 g/mol
Exact Mass329.22
IUPAC NameN-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide
SMILESO=C(NC1CCCC1)N1CCC(N(c2ccncn2)C2CC2)CC1
InChIInChI=1S/C18H27N5O/c24-18(21-14-3-1-2-4-14)22-11-8-16(9-12-22)23(15-5-6-15)17-7-10-19-13-20-17/h7,10,13-16H,1-6,8-9,11-12H2,(H,21,24)
InChIKeySNUBTISDYRKGEZ-UHFFFAOYSA-N
XLogP2.56
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.45
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carbonyl]-1H-pyridin-2-one
CID 126889980
[4-[cyclopropyl(pyrimidin-4-yl)amino]piperidin-1-yl]-(4-methyl-1,3-thiazol-5-yl)methanone
CID 126889978
[4-[cyclopropyl(pyrimidin-4-yl)amino]piperidin-1-yl]-[1-(4-fluorophenyl)cyclopropyl]methanone
CID 126889953
N-(oxan-4-yl)-4-(pyrimidin-4-ylamino)piperidine-1-carboxamide
CID 126887116
[4-[cyclopropyl(pyrimidin-4-yl)amino]piperidin-1-yl]-[3-(difluoromethyl)-1-methylpyrazol-4-yl]methanone
CID 171328772
N-[4-(methoxymethyl)cyclohexyl]-4-pyrimidin-4-ylpiperidine-1-carboxamide
CID 128737509
N-cyclopentyl-3-(dimethylamino)pyrrolidine-1-carboxamide
CID 115610399
N-cycloheptylpiperidine-1-carboxamide
CID 54054704
2-[methyl-[4-[(4-pyridin-4-ylpiperazine-1-carbonyl)amino]cyclohexyl]amino]acetic acid
CID 21462786
N-cyclopropyl-N-[1-(oxan-3-ylmethyl)pyrrolidin-3-yl]pyrimidin-4-amine
CID 171993953
N-cyclohexyl-4-[1-(pyridin-4-ylmethyl)imidazol-2-yl]piperidine-1-carboxamide
CID 72900440
N-cycloheptyl-4-pyrimidin-2-ylpiperazine-1-carboxamide
CID 108990409

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide?
The IUPAC name of N-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide (CID 126889961) is N-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide?
The canonical SMILES for N-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide is O=C(NC1CCCC1)N1CCC(N(c2ccncn2)C2CC2)CC1.
What is the InChIKey of N-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide?
The InChIKey is SNUBTISDYRKGEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N5O/c24-18(21-14-3-1-2-4-14)22-11-8-16(9-12-22)23(15-5-6-15)17-7-10-19-13-20-17/h7,10,13-16H,1-6,8-9,11-12H2,(H,21,24).
What are the key properties of N-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide?
N-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide has a molecular weight of 329.45 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-[cyclopropyl(pyrimidin-4-yl)amino]piperidine-1-carboxamide is sourced from PubChem (CID 126889961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).