N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine

C18H30N4 — CID 13345115

IUPACN-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine
SMILESCC(CNC1CCCCC1)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C18H30N4/c1-16(15-20-17-7-3-2-4-8-17)21-11-13-22(14-12-21)18-9-5-6-10-19-18/h5-6,9-10,16-17,20H,2-4,7-8,11-15H2,1H3
InChIKeyFTZZRXASWZVOAX-UHFFFAOYSA-N
MW302.47 g/mol
LogP2.51
Rot. Bonds5

About N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine

N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine (PubChem CID 13345115) has the molecular formula C18H30N4 and a molecular weight of 302.47 g/mol. Its IUPAC name is N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine.

Molecular Properties

Compound NameN-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine
PubChem CID13345115
Molecular FormulaC18H30N4
Molecular Weight302.47 g/mol
Exact Mass302.25
IUPAC NameN-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine
SMILESCC(CNC1CCCCC1)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C18H30N4/c1-16(15-20-17-7-3-2-4-8-17)21-11-13-22(14-12-21)18-9-5-6-10-19-18/h5-6,9-10,16-17,20H,2-4,7-8,11-15H2,1H3
InChIKeyFTZZRXASWZVOAX-UHFFFAOYSA-N
XLogP2.51
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.47
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-(4-pyridin-2-ylpiperazin-1-yl)propan-1-amine
CID 62423144
2-methyl-N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]propan-2-amine
CID 62423507
(2S)-N-cyclohexyl-2-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 94661500
N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]hexan-1-amine
CID 13345125
N-(cyclohexylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 4030737
N-[2-(azocan-1-yl)propyl]cyclopentanamine
CID 62558696
1,1-difluoro-3-[(1-pyridin-2-ylpiperidin-4-yl)amino]propan-2-ol
CID 103787981
N-[(2R)-2-(4-fluorophenoxy)propyl]-1-pyridin-2-ylpiperidin-4-amine
CID 97323063
N-[(2S)-2-(4-fluorophenoxy)propyl]-1-pyridin-2-ylpiperidin-4-amine
CID 97323062
(2R)-2-[(1-pyridin-2-ylpiperidin-4-yl)amino]propan-1-ol
CID 113260445
N-[2-(4-methylpiperazin-1-yl)propyl]cyclopentanamine
CID 62557293
N-(5-methylhexyl)-1-pyridin-2-ylpiperidin-4-amine
CID 81338605

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine?
The IUPAC name of N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine (CID 13345115) is N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine.
What is the SMILES notation for N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine?
The canonical SMILES for N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine is CC(CNC1CCCCC1)N1CCN(c2ccccn2)CC1.
What is the InChIKey of N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine?
The InChIKey is FTZZRXASWZVOAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N4/c1-16(15-20-17-7-3-2-4-8-17)21-11-13-22(14-12-21)18-9-5-6-10-19-18/h5-6,9-10,16-17,20H,2-4,7-8,11-15H2,1H3.
What are the key properties of N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine?
N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine has a molecular weight of 302.47 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-pyridin-2-ylpiperazin-1-yl)propyl]cyclohexanamine is sourced from PubChem (CID 13345115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).