1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine

C17H34N2 — CID 79069589

IUPAC1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine
SMILESCCNC(CC1CCCC1)C(C)(CC)N1CCCC1
InChIInChI=1S/C17H34N2/c1-4-17(3,19-12-8-9-13-19)16(18-5-2)14-15-10-6-7-11-15/h15-16,18H,4-14H2,1-3H3
InChIKeyYHEBNQMBIRMGRL-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.81
Rot. Bonds7

About 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine

1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine (PubChem CID 79069589) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine.

Molecular Properties

Compound Name1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine
PubChem CID79069589
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine
SMILESCCNC(CC1CCCC1)C(C)(CC)N1CCCC1
InChIInChI=1S/C17H34N2/c1-4-17(3,19-12-8-9-13-19)16(18-5-2)14-15-10-6-7-11-15/h15-16,18H,4-14H2,1-3H3
InChIKeyYHEBNQMBIRMGRL-UHFFFAOYSA-N
XLogP3.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine?
The IUPAC name of 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine (CID 79069589) is 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine.
What is the SMILES notation for 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine?
The canonical SMILES for 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine is CCNC(CC1CCCC1)C(C)(CC)N1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine?
The InChIKey is YHEBNQMBIRMGRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-4-17(3,19-12-8-9-13-19)16(18-5-2)14-15-10-6-7-11-15/h15-16,18H,4-14H2,1-3H3.
What are the key properties of 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine?
1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine has a molecular weight of 266.47 g/mol, XLogP of 3.81, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine is sourced from PubChem (CID 79069589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).