2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine

C15H29N3 — CID 62610911

IUPAC2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine
SMILESCNC1CCCC1CN1CCN(CC2CC2)CC1
InChIInChI=1S/C15H29N3/c1-16-15-4-2-3-14(15)12-18-9-7-17(8-10-18)11-13-5-6-13/h13-16H,2-12H2,1H3
InChIKeySLXLZXSHMWTUBG-UHFFFAOYSA-N
MW251.42 g/mol
LogP1.40
Rot. Bonds5

About 2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine

2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine (PubChem CID 62610911) has the molecular formula C15H29N3 and a molecular weight of 251.42 g/mol. Its IUPAC name is 2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine.

Molecular Properties

Compound Name2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine
PubChem CID62610911
Molecular FormulaC15H29N3
Molecular Weight251.42 g/mol
Exact Mass251.24
IUPAC Name2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine
SMILESCNC1CCCC1CN1CCN(CC2CC2)CC1
InChIInChI=1S/C15H29N3/c1-16-15-4-2-3-14(15)12-18-9-7-17(8-10-18)11-13-5-6-13/h13-16H,2-12H2,1H3
InChIKeySLXLZXSHMWTUBG-UHFFFAOYSA-N
XLogP1.40
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.42
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine?
The IUPAC name of 2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine (CID 62610911) is 2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine.
What is the SMILES notation for 2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine?
The canonical SMILES for 2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine is CNC1CCCC1CN1CCN(CC2CC2)CC1.
What is the InChIKey of 2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine?
The InChIKey is SLXLZXSHMWTUBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3/c1-16-15-4-2-3-14(15)12-18-9-7-17(8-10-18)11-13-5-6-13/h13-16H,2-12H2,1H3.
What are the key properties of 2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine?
2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine has a molecular weight of 251.42 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(cyclopropylmethyl)piperazin-1-yl]methyl]-N-methylcyclopentan-1-amine is sourced from PubChem (CID 62610911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).