N-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine

C13H23N3 — CID 115894801

IUPACN-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine
SMILESCc1cc(CC(C)NC(C)C2(C)CC2)n[nH]1
InChIInChI=1S/C13H23N3/c1-9(7-12-8-10(2)15-16-12)14-11(3)13(4)5-6-13/h8-9,11,14H,5-7H2,1-4H3,(H,15,16)
InChIKeyKAYXGOLZKUZVJZ-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.43
Rot. Bonds5

About N-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine

N-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine (PubChem CID 115894801) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is N-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine.

Molecular Properties

Compound NameN-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine
PubChem CID115894801
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC NameN-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine
SMILESCc1cc(CC(C)NC(C)C2(C)CC2)n[nH]1
InChIInChI=1S/C13H23N3/c1-9(7-12-8-10(2)15-16-12)14-11(3)13(4)5-6-13/h8-9,11,14H,5-7H2,1-4H3,(H,15,16)
InChIKeyKAYXGOLZKUZVJZ-UHFFFAOYSA-N
XLogP2.43
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-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

(1R)-2,2-dimethyl-N-[(2S)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]cyclopentan-1-amine
CID 97104049
(3S)-1-(azepan-1-yl)-3-[[(2S)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]amino]butan-1-one
CID 97104008
N-[1-(2,4-dimethylpyrimidin-5-yl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine
CID 136520198
(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine
CID 1419095
3,3-dimethyl-N-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]butan-1-amine
CID 99824923
1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine;hydrochloride
CID 170893704
1-(methoxymethyl)-N-[(2S)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]cyclobutane-1-carboxamide
CID 95126675
5-bromo-N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrimidin-2-amine
CID 133378217
N-methyl-4-[(1S)-1-[[(2S)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]amino]ethyl]benzenesulfonamide
CID 97104029
1-[(2S)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-3-[(3R)-2,2,5,5-tetramethyloxolan-3-yl]urea
CID 99820417
1-(2-fluorophenyl)-N-[(2R)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]cyclopropane-1-carboxamide
CID 95143367
1-(2-fluorophenyl)-N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]cyclopropane-1-carboxamide
CID 50980084

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine?
The IUPAC name of N-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine (CID 115894801) is N-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine.
What is the SMILES notation for N-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine?
The canonical SMILES for N-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine is Cc1cc(CC(C)NC(C)C2(C)CC2)n[nH]1.
What is the InChIKey of N-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine?
The InChIKey is KAYXGOLZKUZVJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-9(7-12-8-10(2)15-16-12)14-11(3)13(4)5-6-13/h8-9,11,14H,5-7H2,1-4H3,(H,15,16).
What are the key properties of N-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine?
N-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine has a molecular weight of 221.35 g/mol, XLogP of 2.43, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-methylcyclopropyl)ethyl]-1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine is sourced from PubChem (CID 115894801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).