N-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine

C18H35N3 — CID 62574223

IUPACN-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine
SMILESC1CCC(NCCN2CCC(N3CCCCC3)CC2)CC1
InChIInChI=1S/C18H35N3/c1-3-7-17(8-4-1)19-11-16-20-14-9-18(10-15-20)21-12-5-2-6-13-21/h17-19H,1-16H2
InChIKeySRUHUKYDAGHWJD-UHFFFAOYSA-N
MW293.50 g/mol
LogP2.86
Rot. Bonds5

About N-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine

N-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine (PubChem CID 62574223) has the molecular formula C18H35N3 and a molecular weight of 293.50 g/mol. Its IUPAC name is N-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine.

Molecular Properties

Compound NameN-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine
PubChem CID62574223
Molecular FormulaC18H35N3
Molecular Weight293.50 g/mol
Exact Mass293.28
IUPAC NameN-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine
SMILESC1CCC(NCCN2CCC(N3CCCCC3)CC2)CC1
InChIInChI=1S/C18H35N3/c1-3-7-17(8-4-1)19-11-16-20-14-9-18(10-15-20)21-12-5-2-6-13-21/h17-19H,1-16H2
InChIKeySRUHUKYDAGHWJD-UHFFFAOYSA-N
XLogP2.86
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.50
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-pyrrolidin-1-ylethyl)cyclohexanamine
CID 43181622
N-[2-(azepan-1-yl)ethyl]cyclopropanamine
CID 54773126
N-(2-pyrrolidin-1-ylethyl)cyclopropanamine
CID 54773109
N-(cyclopentylmethyl)-2-(4-piperidin-1-ylpiperidin-1-yl)ethanamine
CID 62561801
N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexanamine
CID 60701363
4-methyl-N-[2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethyl]cyclohexan-1-amine
CID 63167536
N-[2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)ethyl]cyclohexanamine
CID 79118522
N-(2-thiomorpholin-4-ylethyl)cyclohexanamine
CID 62573834
2-methyl-N-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]propan-2-amine
CID 61387313
N-[2-(4-methylpiperazin-1-yl)ethyl]cyclopentanamine
CID 60701361
N-[2-(4,4-dimethylpiperidin-1-yl)ethyl]cycloheptanamine
CID 62932033
N-[2-(azepan-1-yl)ethyl]-1-ethylpiperidin-4-amine
CID 61240570

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine?
The IUPAC name of N-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine (CID 62574223) is N-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine.
What is the SMILES notation for N-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine?
The canonical SMILES for N-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine is C1CCC(NCCN2CCC(N3CCCCC3)CC2)CC1.
What is the InChIKey of N-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine?
The InChIKey is SRUHUKYDAGHWJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N3/c1-3-7-17(8-4-1)19-11-16-20-14-9-18(10-15-20)21-12-5-2-6-13-21/h17-19H,1-16H2.
What are the key properties of N-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine?
N-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine has a molecular weight of 293.50 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexanamine is sourced from PubChem (CID 62574223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).