(3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide

C10H21N3O — CID 89470271

IUPAC(3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide
SMILESCC(C)CNC(=O)[C@@H]1CN(C)C[C@@H]1N
InChIInChI=1S/C10H21N3O/c1-7(2)4-12-10(14)8-5-13(3)6-9(8)11/h7-9H,4-6,11H2,1-3H3,(H,12,14)/t8-,9+/m1/s1
InChIKeyLMXJOGIGEJQDRQ-BDAKNGLRSA-N
MW199.30 g/mol
LogP-0.35
Rot. Bonds3

About (3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide

(3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide (PubChem CID 89470271) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is (3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide
PubChem CID89470271
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name(3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide
SMILESCC(C)CNC(=O)[C@@H]1CN(C)C[C@@H]1N
InChIInChI=1S/C10H21N3O/c1-7(2)4-12-10(14)8-5-13(3)6-9(8)11/h7-9H,4-6,11H2,1-3H3,(H,12,14)/t8-,9+/m1/s1
InChIKeyLMXJOGIGEJQDRQ-BDAKNGLRSA-N
XLogP-0.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide 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

2-amino-N-[2-(dimethylamino)propyl]cyclopropane-1-carboxamide
CID 114995868
2-amino-3-methyl-N-(2-methylpropyl)cyclohexane-1-carboxamide
CID 62776500
(3R,4R)-4-amino-1-methyl-N-(pyridin-3-ylmethyl)pyrrolidine-3-carboxamide
CID 89470272
4-amino-N-[3-methyl-2-(4-methylpiperazin-1-yl)butyl]oxolane-3-carboxamide
CID 66235852
2-(2-methylpropylcarbamoyl)cyclohexane-1-carboxylic acid
CID 3133162
4-amino-N-[3-(2-methylpropylamino)-3-oxopropyl]oxolane-3-carboxamide
CID 113410096
N,1-bis(2-methylpropyl)piperidine-4-carboxamide
CID 883892
2-amino-N-[(2S)-2-hydroxypropyl]cyclohexane-1-carboxamide
CID 107221074
2-amino-N-(2-hydroxy-4-methylpentyl)cyclopentane-1-carboxamide
CID 103812101
2-amino-N-(3-methoxy-2-methylpropyl)cyclopropane-1-carboxamide
CID 114995893
4-ethyl-2-(2-methylpropylcarbamoyl)cyclopentane-1-carboxylic acid
CID 114511327
1,4-dimethylpiperazine;2-methyl-N-(2-methylpropyl)propanamide
CID 163271677

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide?
The IUPAC name of (3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide (CID 89470271) is (3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for (3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide?
The canonical SMILES for (3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide is CC(C)CNC(=O)[C@@H]1CN(C)C[C@@H]1N.
What is the InChIKey of (3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide?
The InChIKey is LMXJOGIGEJQDRQ-BDAKNGLRSA-N. The full InChI is InChI=1S/C10H21N3O/c1-7(2)4-12-10(14)8-5-13(3)6-9(8)11/h7-9H,4-6,11H2,1-3H3,(H,12,14)/t8-,9+/m1/s1.
What are the key properties of (3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide?
(3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide has a molecular weight of 199.30 g/mol, XLogP of -0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-4-amino-1-methyl-N-(2-methylpropyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 89470271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).