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

C12H26N2 — CID 79069202

IUPACN-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine
SMILESCCNC(C)C(C)(CC)N1CCCC1
InChIInChI=1S/C12H26N2/c1-5-12(4,11(3)13-6-2)14-9-7-8-10-14/h11,13H,5-10H2,1-4H3
InChIKeyYJYHDVKZEYYNOX-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.25
Rot. Bonds5

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

N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine (PubChem CID 79069202) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine.

Molecular Properties

Compound NameN-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine
PubChem CID79069202
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC NameN-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine
SMILESCCNC(C)C(C)(CC)N1CCCC1
InChIInChI=1S/C12H26N2/c1-5-12(4,11(3)13-6-2)14-9-7-8-10-14/h11,13H,5-10H2,1-4H3
InChIKeyYJYHDVKZEYYNOX-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine
CID 79069589
N-ethyl-3-methyl-3-pyrrolidin-1-yloctan-4-amine
CID 79069200
N-ethyl-3,7,7-trimethyl-3-piperidin-1-yloctan-4-amine
CID 79064855
N-ethyl-2,4-dimethyl-4-piperidin-1-ylhex-1-en-3-amine
CID 79179721
N-ethyl-1-ethylsulfonyl-5-methyl-5-pyrrolidin-1-ylheptan-4-amine
CID 79059543
N-ethyl-2-methyl-1-(3-methylphenyl)-2-piperidin-1-ylbutan-1-amine
CID 79060679
N,3,7-trimethyl-3-piperidin-1-yloctan-4-amine
CID 79065446
3-methyl-N-propyl-3-pyrrolidin-1-ylheptan-4-amine
CID 79069357
N,4-dimethyl-4-piperidin-1-ylhexan-3-amine
CID 79065370
N-ethyl-2-methyl-1-(3-methylcyclohexyl)-2-pyrrolidin-1-ylbutan-1-amine
CID 79069201
1-(cyclohexen-1-yl)-N-ethyl-2-methyl-2-pyrrolidin-1-ylbutan-1-amine
CID 106653615
N,3-diethyl-5-methyl-3-pyrrolidin-1-yloctan-4-amine
CID 107896656

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine?
The IUPAC name of N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine (CID 79069202) is N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine.
What is the SMILES notation for N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine?
The canonical SMILES for N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine is CCNC(C)C(C)(CC)N1CCCC1.
What is the InChIKey of N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine?
The InChIKey is YJYHDVKZEYYNOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-5-12(4,11(3)13-6-2)14-9-7-8-10-14/h11,13H,5-10H2,1-4H3.
What are the key properties of N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine?
N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine has a molecular weight of 198.35 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methyl-3-pyrrolidin-1-ylpentan-2-amine is sourced from PubChem (CID 79069202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).