1-cyclopropyl-3-methylpentan-2-amine

C9H19N — CID 64904257

IUPAC1-cyclopropyl-3-methylpentan-2-amine
SMILESCCC(C)C(N)CC1CC1
InChIInChI=1S/C9H19N/c1-3-7(2)9(10)6-8-4-5-8/h7-9H,3-6,10H2,1-2H3
InChIKeyGCPZHNCUXWHUEH-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.16
Rot. Bonds4

About 1-cyclopropyl-3-methylpentan-2-amine

1-cyclopropyl-3-methylpentan-2-amine (PubChem CID 64904257) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is 1-cyclopropyl-3-methylpentan-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-3-methylpentan-2-amine
PubChem CID64904257
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name1-cyclopropyl-3-methylpentan-2-amine
SMILESCCC(C)C(N)CC1CC1
InChIInChI=1S/C9H19N/c1-3-7(2)9(10)6-8-4-5-8/h7-9H,3-6,10H2,1-2H3
InChIKeyGCPZHNCUXWHUEH-UHFFFAOYSA-N
XLogP2.16
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-methylpentan-2-amine?
The IUPAC name of 1-cyclopropyl-3-methylpentan-2-amine (CID 64904257) is 1-cyclopropyl-3-methylpentan-2-amine.
What is the SMILES notation for 1-cyclopropyl-3-methylpentan-2-amine?
The canonical SMILES for 1-cyclopropyl-3-methylpentan-2-amine is CCC(C)C(N)CC1CC1.
What is the InChIKey of 1-cyclopropyl-3-methylpentan-2-amine?
The InChIKey is GCPZHNCUXWHUEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-3-7(2)9(10)6-8-4-5-8/h7-9H,3-6,10H2,1-2H3.
What are the key properties of 1-cyclopropyl-3-methylpentan-2-amine?
1-cyclopropyl-3-methylpentan-2-amine has a molecular weight of 141.26 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-methylpentan-2-amine is sourced from PubChem (CID 64904257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).