4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine

C14H27N3 — CID 11586738

IUPAC4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine
SMILESNC1CCC(N2CCN(CC3CC3)CC2)CC1
InChIInChI=1S/C14H27N3/c15-13-3-5-14(6-4-13)17-9-7-16(8-10-17)11-12-1-2-12/h12-14H,1-11,15H2
InChIKeyLBYALFWGJOLWMN-UHFFFAOYSA-N
MW237.39 g/mol
LogP1.28
Rot. Bonds3

About 4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine

4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine (PubChem CID 11586738) has the molecular formula C14H27N3 and a molecular weight of 237.39 g/mol. Its IUPAC name is 4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine
PubChem CID11586738
Molecular FormulaC14H27N3
Molecular Weight237.39 g/mol
Exact Mass237.22
IUPAC Name4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine
SMILESNC1CCC(N2CCN(CC3CC3)CC2)CC1
InChIInChI=1S/C14H27N3/c15-13-3-5-14(6-4-13)17-9-7-16(8-10-17)11-12-1-2-12/h12-14H,1-11,15H2
InChIKeyLBYALFWGJOLWMN-UHFFFAOYSA-N
XLogP1.28
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine?
The IUPAC name of 4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine (CID 11586738) is 4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine.
What is the SMILES notation for 4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine?
The canonical SMILES for 4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine is NC1CCC(N2CCN(CC3CC3)CC2)CC1.
What is the InChIKey of 4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine?
The InChIKey is LBYALFWGJOLWMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3/c15-13-3-5-14(6-4-13)17-9-7-16(8-10-17)11-12-1-2-12/h12-14H,1-11,15H2.
What are the key properties of 4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine?
4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine has a molecular weight of 237.39 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexan-1-amine is sourced from PubChem (CID 11586738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).