2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine

C10H19N3 — CID 62448113

IUPAC2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine
SMILESCC(CNC(C)C)Cn1cccn1
InChIInChI=1S/C10H19N3/c1-9(2)11-7-10(3)8-13-6-4-5-12-13/h4-6,9-11H,7-8H2,1-3H3
InChIKeyNOFZZVDCHBGMTE-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.52
Rot. Bonds5

About 2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine

2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine (PubChem CID 62448113) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is 2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine.

Molecular Properties

Compound Name2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine
PubChem CID62448113
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC Name2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine
SMILESCC(CNC(C)C)Cn1cccn1
InChIInChI=1S/C10H19N3/c1-9(2)11-7-10(3)8-13-6-4-5-12-13/h4-6,9-11H,7-8H2,1-3H3
InChIKeyNOFZZVDCHBGMTE-UHFFFAOYSA-N
XLogP1.52
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-pyrazol-1-ylpropan-2-amine
CID 43435880
1-(1-pyrazol-1-ylpropan-2-ylamino)butan-2-ol
CID 61462811
5-chloro-N-[(2R)-2-methyl-3-pyrazol-1-ylpropyl]pyridin-2-amine
CID 97119017
1-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-3-pyrazol-1-ylpropan-2-ol
CID 62991007
N-[(2R)-2-methyl-3-pyrazol-1-ylpropyl]-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 129320693
2-methyl-3-(1-pyrazol-1-ylpropan-2-ylamino)propanoic acid
CID 61462644
N-(2-fluoroethyl)-1-pyrazol-1-ylpropan-2-amine
CID 80601447
(2S)-2-amino-4-methyl-N-(2-methyl-3-pyrazol-1-ylpropyl)pentanamide;hydrochloride
CID 119734157
2,4,6-trimethyl-N-(2-methyl-3-pyrazol-1-ylpropyl)benzenesulfonamide
CID 60539912
3-methyl-1-pyrazol-1-ylbutane-2-thiol
CID 165469811
3-methyl-4-pyrazol-1-ylbutan-2-ol
CID 142163216
1-(2-methylpropylamino)-3-pyrazol-1-ylpropan-2-ol
CID 60904302

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine?
The IUPAC name of 2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine (CID 62448113) is 2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine.
What is the SMILES notation for 2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine?
The canonical SMILES for 2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine is CC(CNC(C)C)Cn1cccn1.
What is the InChIKey of 2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine?
The InChIKey is NOFZZVDCHBGMTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3/c1-9(2)11-7-10(3)8-13-6-4-5-12-13/h4-6,9-11H,7-8H2,1-3H3.
What are the key properties of 2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine?
2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine has a molecular weight of 181.28 g/mol, XLogP of 1.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-propan-2-yl-3-pyrazol-1-ylpropan-1-amine is sourced from PubChem (CID 62448113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).