N-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine

C14H26N2 — CID 106621852

IUPACN-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine
SMILESC1CCC(CN(CC2CCC2)C2CC2)NC1
InChIInChI=1S/C14H26N2/c1-2-9-15-13(6-1)11-16(14-7-8-14)10-12-4-3-5-12/h12-15H,1-11H2
InChIKeyNSGXNZSQJBWQLU-UHFFFAOYSA-N
MW222.38 g/mol
LogP2.39
Rot. Bonds5

About N-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine

N-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine (PubChem CID 106621852) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine
PubChem CID106621852
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC NameN-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine
SMILESC1CCC(CN(CC2CCC2)C2CC2)NC1
InChIInChI=1S/C14H26N2/c1-2-9-15-13(6-1)11-16(14-7-8-14)10-12-4-3-5-12/h12-15H,1-11H2
InChIKeyNSGXNZSQJBWQLU-UHFFFAOYSA-N
XLogP2.39
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine?
The IUPAC name of N-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine (CID 106621852) is N-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine.
What is the SMILES notation for N-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine?
The canonical SMILES for N-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine is C1CCC(CN(CC2CCC2)C2CC2)NC1.
What is the InChIKey of N-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine?
The InChIKey is NSGXNZSQJBWQLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-2-9-15-13(6-1)11-16(14-7-8-14)10-12-4-3-5-12/h12-15H,1-11H2.
What are the key properties of N-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine?
N-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine has a molecular weight of 222.38 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine is sourced from PubChem (CID 106621852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).