N-propan-2-yl-N-propylcyclopentanamine

C11H23N — CID 54134740

IUPACN-propan-2-yl-N-propylcyclopentanamine
SMILESCCCN(C(C)C)C1CCCC1
InChIInChI=1S/C11H23N/c1-4-9-12(10(2)3)11-7-5-6-8-11/h10-11H,4-9H2,1-3H3
InChIKeyKBXXVLYFODWJKR-UHFFFAOYSA-N
MW169.31 g/mol
LogP3.05
Rot. Bonds4

About N-propan-2-yl-N-propylcyclopentanamine

N-propan-2-yl-N-propylcyclopentanamine (PubChem CID 54134740) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N-propan-2-yl-N-propylcyclopentanamine.

Molecular Properties

Compound NameN-propan-2-yl-N-propylcyclopentanamine
PubChem CID54134740
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN-propan-2-yl-N-propylcyclopentanamine
SMILESCCCN(C(C)C)C1CCCC1
InChIInChI=1S/C11H23N/c1-4-9-12(10(2)3)11-7-5-6-8-11/h10-11H,4-9H2,1-3H3
InChIKeyKBXXVLYFODWJKR-UHFFFAOYSA-N
XLogP3.05
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-N-propylcyclopentanamine?
The IUPAC name of N-propan-2-yl-N-propylcyclopentanamine (CID 54134740) is N-propan-2-yl-N-propylcyclopentanamine.
What is the SMILES notation for N-propan-2-yl-N-propylcyclopentanamine?
The canonical SMILES for N-propan-2-yl-N-propylcyclopentanamine is CCCN(C(C)C)C1CCCC1.
What is the InChIKey of N-propan-2-yl-N-propylcyclopentanamine?
The InChIKey is KBXXVLYFODWJKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-4-9-12(10(2)3)11-7-5-6-8-11/h10-11H,4-9H2,1-3H3.
What are the key properties of N-propan-2-yl-N-propylcyclopentanamine?
N-propan-2-yl-N-propylcyclopentanamine has a molecular weight of 169.31 g/mol, XLogP of 3.05, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-N-propylcyclopentanamine is sourced from PubChem (CID 54134740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).