N-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine

C20H29N5 — CID 123958418

IUPACN-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine
SMILESCc1cnc(N2CCC(NC3CCCCC3)CC2)c(-c2ccn[nH]2)c1
InChIInChI=1S/C20H29N5/c1-15-13-18(19-7-10-22-24-19)20(21-14-15)25-11-8-17(9-12-25)23-16-5-3-2-4-6-16/h7,10,13-14,16-17,23H,2-6,8-9,11-12H2,1H3,(H,22,24)
InChIKeyCBRVXUSYYOWLEV-UHFFFAOYSA-N
MW339.49 g/mol
LogP3.67
Rot. Bonds4

About N-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine

N-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine (PubChem CID 123958418) has the molecular formula C20H29N5 and a molecular weight of 339.49 g/mol. Its IUPAC name is N-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine.

Molecular Properties

Compound NameN-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine
PubChem CID123958418
Molecular FormulaC20H29N5
Molecular Weight339.49 g/mol
Exact Mass339.24
IUPAC NameN-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine
SMILESCc1cnc(N2CCC(NC3CCCCC3)CC2)c(-c2ccn[nH]2)c1
InChIInChI=1S/C20H29N5/c1-15-13-18(19-7-10-22-24-19)20(21-14-15)25-11-8-17(9-12-25)23-16-5-3-2-4-6-16/h7,10,13-14,16-17,23H,2-6,8-9,11-12H2,1H3,(H,22,24)
InChIKeyCBRVXUSYYOWLEV-UHFFFAOYSA-N
XLogP3.67
TPSA56.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.49
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;methyl 2-[4-(cyclohexylamino)piperidin-1-yl]-5-methylpyridine-3-carboxylate
CID 144575641
6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxylic acid
CID 177169705
N-cyclohexyl-3-methyl-1-[5-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]piperidin-4-amine
CID 118263755
N-cyclohexyl-1-(6-methyl-3-pyrimidin-4-ylquinolin-2-yl)piperidin-4-amine
CID 118264097
N-cyclohexyl-1-[6-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridazin-3-yl]piperidin-4-amine
CID 129252298
[4-(cycloheptylamino)-1-[5-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]piperidin-3-yl]methanol
CID 118263750
5-bromo-2-[4-(cyclohexylamino)piperidin-1-yl]-N-methylpyridine-3-carboxamide
CID 73295355
N-(1-aminoethylidene)-6-[4-(cyclohexylamino)piperidin-1-yl]-5-methylpyridine-3-carboxamide
CID 123842941
N-cyclopentyl-1-[6-methyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)quinolin-2-yl]piperidin-4-amine
CID 129252293
N-(1-aminoethyl)-2-[4-(cyclohexylamino)piperidin-1-yl]-5-cyclopropylpyridine-3-carboxamide
CID 123519804
N-(1-aminoethyl)-2-[4-(cyclohexylamino)-3-methoxypiperidin-1-yl]-5-methylpyridine-3-carboxamide
CID 123966369
(Z)-1-[2-[4-(cyclohexylamino)-3-methoxypiperidin-1-yl]-5-methyl-3-pyridinyl]-N'-methylethene-1,2-diamine
CID 139324738

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine?
The IUPAC name of N-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine (CID 123958418) is N-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine.
What is the SMILES notation for N-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine?
The canonical SMILES for N-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine is Cc1cnc(N2CCC(NC3CCCCC3)CC2)c(-c2ccn[nH]2)c1.
What is the InChIKey of N-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine?
The InChIKey is CBRVXUSYYOWLEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N5/c1-15-13-18(19-7-10-22-24-19)20(21-14-15)25-11-8-17(9-12-25)23-16-5-3-2-4-6-16/h7,10,13-14,16-17,23H,2-6,8-9,11-12H2,1H3,(H,22,24).
What are the key properties of N-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine?
N-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine has a molecular weight of 339.49 g/mol, XLogP of 3.67, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-[5-methyl-3-(1H-pyrazol-5-yl)-2-pyridinyl]piperidin-4-amine is sourced from PubChem (CID 123958418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).