N-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide

C19H31N5O2 — CID 135674466

IUPACN-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide
SMILESCc1nc(NC2CCN(CC(=O)NC3CCCCC3)CC2)[nH]c(=O)c1C
InChIInChI=1S/C19H31N5O2/c1-13-14(2)20-19(23-18(13)26)22-16-8-10-24(11-9-16)12-17(25)21-15-6-4-3-5-7-15/h15-16H,3-12H2,1-2H3,(H,21,25)(H2,20,22,23,26)
InChIKeyVJGYZBBBFMMQAQ-UHFFFAOYSA-N
MW361.49 g/mol
LogP1.71
Rot. Bonds5

About N-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide

N-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide (PubChem CID 135674466) has the molecular formula C19H31N5O2 and a molecular weight of 361.49 g/mol. Its IUPAC name is N-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide
PubChem CID135674466
Molecular FormulaC19H31N5O2
Molecular Weight361.49 g/mol
Exact Mass361.25
IUPAC NameN-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide
SMILESCc1nc(NC2CCN(CC(=O)NC3CCCCC3)CC2)[nH]c(=O)c1C
InChIInChI=1S/C19H31N5O2/c1-13-14(2)20-19(23-18(13)26)22-16-8-10-24(11-9-16)12-17(25)21-15-6-4-3-5-7-15/h15-16H,3-12H2,1-2H3,(H,21,25)(H2,20,22,23,26)
InChIKeyVJGYZBBBFMMQAQ-UHFFFAOYSA-N
XLogP1.71
TPSA90.12 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.49
LogP ≤ 51.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide with MolForge

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Related Compounds

1-cyclohexyl-3-(2-(4,5-dimethyl-6-oxopyrimidin-1(6H)-yl)ethyl)urea
CID 71795201
6-cyclohexyl-2-methoxy-3,8-dimethyl-8,9-dihydro-5H-pyrimido[4,5-e][1,4]diazepine-4,7-dione
CID 54613122
N-cyclohexyl-N-methyl-2-(4-oxo-2-pyrrolidin-1-yl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-6-yl)acetamide
CID 136143906
3-[2-[4-(5-Fluoro-4-oxo-6-propan-2-yl-1,3-diazinan-2-yl)piperazin-1-yl]-2-oxoethyl]-5,6-dimethylpyrimidin-4-one
CID 168003790
4,5-dimethyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-1H-pyrimidin-6-one
CID 135674584
4-methyl-2-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1H-pyrimidin-6-one
CID 135719556
N-cyclohexyl-2-[4-[(4-ethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide
CID 135719626
N-cyclohexyl-2-(4-oxo-2-pyrrolidin-1-yl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-6-yl)acetamide
CID 136143907
6-[2-(2,6-Dimethylpiperidin-1-yl)-2-oxoethyl]-2-pyrrolidin-1-yl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 136253575
6-[2-(2-Methylpiperidin-1-yl)-2-oxoethyl]-2-pyrrolidin-1-yl-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 136263302
N-cyclohexyl-2-[4-(4-methyl-6-oxo-1H-pyrimidin-2-yl)piperazin-1-yl]acetamide
CID 136907837
N,N-diethyl-2-[4-[(4-oxo-5,6,7,8-tetrahydro-3H-quinazolin-2-yl)amino]piperidin-1-yl]acetamide
CID 137058269

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide?
The IUPAC name of N-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide (CID 135674466) is N-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide.
What is the SMILES notation for N-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide?
The canonical SMILES for N-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide is Cc1nc(NC2CCN(CC(=O)NC3CCCCC3)CC2)[nH]c(=O)c1C.
What is the InChIKey of N-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide?
The InChIKey is VJGYZBBBFMMQAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N5O2/c1-13-14(2)20-19(23-18(13)26)22-16-8-10-24(11-9-16)12-17(25)21-15-6-4-3-5-7-15/h15-16H,3-12H2,1-2H3,(H,21,25)(H2,20,22,23,26).
What are the key properties of N-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide?
N-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide has a molecular weight of 361.49 g/mol, XLogP of 1.71, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[4-[(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)amino]piperidin-1-yl]acetamide is sourced from PubChem (CID 135674466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).