N-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine

C14H29N3 — CID 115255716

IUPACN-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine
SMILESCC(CNCC1CCCCC1)N1CCNCC1
InChIInChI=1S/C14H29N3/c1-13(17-9-7-15-8-10-17)11-16-12-14-5-3-2-4-6-14/h13-16H,2-12H2,1H3
InChIKeyPYYORAZKPBDSIN-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.45
Rot. Bonds5

About N-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine

N-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine (PubChem CID 115255716) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine
PubChem CID115255716
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC NameN-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine
SMILESCC(CNCC1CCCCC1)N1CCNCC1
InChIInChI=1S/C14H29N3/c1-13(17-9-7-15-8-10-17)11-16-12-14-5-3-2-4-6-14/h13-16H,2-12H2,1H3
InChIKeyPYYORAZKPBDSIN-UHFFFAOYSA-N
XLogP1.45
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1-methylpiperidin-4-yl)methyl]-2-piperazin-1-ylpropan-1-amine
CID 115255719
N-(oxan-4-ylmethyl)-2-piperazin-1-ylpropan-1-amine
CID 115255717
N-(cyclohexylmethyl)-2-methyl-3-piperazin-1-ylpropan-1-amine
CID 115255377
N-(oxan-4-ylmethyl)-2-piperidin-1-ylpropan-1-amine
CID 55066116
1-(1-cyclohexylsulfanylpropan-2-yl)piperazine
CID 117035734
N-(cyclohexylmethyl)-2,2-dimethyl-3-piperazin-1-ylpropan-1-amine
CID 115255287
1-cyclopentyl-N-(piperazin-1-ylmethyl)methanamine
CID 115230038
2-chloro-N-(cyclopentylmethyl)propan-1-amine
CID 65024059
1-N-(cyclopentylmethyl)propane-1,2-diamine
CID 115196604
3-methyl-N-(piperidin-4-ylmethyl)-2-propan-2-ylbutan-1-amine
CID 102904206
1-(1,3-dicyclohexylpropan-2-yl)piperazine;dihydrochloride
CID 69431994
N-(oxan-4-ylmethyl)-3-piperazin-1-ylbutanamide
CID 115189158

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine?
The IUPAC name of N-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine (CID 115255716) is N-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine.
What is the SMILES notation for N-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine?
The canonical SMILES for N-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine is CC(CNCC1CCCCC1)N1CCNCC1.
What is the InChIKey of N-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine?
The InChIKey is PYYORAZKPBDSIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-13(17-9-7-15-8-10-17)11-16-12-14-5-3-2-4-6-14/h13-16H,2-12H2,1H3.
What are the key properties of N-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine?
N-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine has a molecular weight of 239.41 g/mol, XLogP of 1.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-2-piperazin-1-ylpropan-1-amine is sourced from PubChem (CID 115255716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).