N-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine

C12H21N3 — CID 115921375

IUPACN-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine
SMILESCCCn1cc(NC(C)CC2CC2)cn1
InChIInChI=1S/C12H21N3/c1-3-6-15-9-12(8-13-15)14-10(2)7-11-4-5-11/h8-11,14H,3-7H2,1-2H3
InChIKeyILJHWIXBXMDTMG-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.89
Rot. Bonds6

About N-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine

N-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine (PubChem CID 115921375) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is N-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine.

Molecular Properties

Compound NameN-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine
PubChem CID115921375
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC NameN-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine
SMILESCCCn1cc(NC(C)CC2CC2)cn1
InChIInChI=1S/C12H21N3/c1-3-6-15-9-12(8-13-15)14-10(2)7-11-4-5-11/h8-11,14H,3-7H2,1-2H3
InChIKeyILJHWIXBXMDTMG-UHFFFAOYSA-N
XLogP2.89
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyclobutylpropan-2-yl)-1-propylpyrazol-4-amine
CID 115921376
N-pentan-2-yl-1-propylpyrazol-4-amine
CID 115921377
N-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine
CID 97338513
1-propyl-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrazol-4-amine
CID 97309859
1-propyl-N-[(2R)-4-pyrazol-1-ylbutan-2-yl]pyrazol-4-amine
CID 97342085
N-[(2R)-4-methoxy-4-methylpentan-2-yl]-1-propylpyrazol-4-amine
CID 97338512
N-(3-methylhex-5-en-2-yl)-1-propylpyrazol-4-amine
CID 115921396
2-[4-(butan-2-ylamino)pyrazol-1-yl]ethanol
CID 115922691
1-(2-methoxyethyl)-N-[1-(1-propylpiperidin-4-yl)ethyl]pyrazol-4-amine
CID 43728912
1-ethyl-N-(1-pyrrolidin-2-ylpropan-2-yl)pyrazol-4-amine
CID 79540648
N-[(2S)-1-(2-fluorophenyl)propan-2-yl]-1-propylpyrazol-4-amine
CID 99825558
tert-butyl 3-[2-[(1-propylpyrazol-4-yl)amino]propyl]morpholine-4-carboxylate
CID 75458582

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine?
The IUPAC name of N-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine (CID 115921375) is N-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine.
What is the SMILES notation for N-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine?
The canonical SMILES for N-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine is CCCn1cc(NC(C)CC2CC2)cn1.
What is the InChIKey of N-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine?
The InChIKey is ILJHWIXBXMDTMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-3-6-15-9-12(8-13-15)14-10(2)7-11-4-5-11/h8-11,14H,3-7H2,1-2H3.
What are the key properties of N-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine?
N-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine has a molecular weight of 207.32 g/mol, XLogP of 2.89, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine is sourced from PubChem (CID 115921375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).