N-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine

C10H19N3O — CID 97338513

IUPACN-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine
SMILESCCCn1cc(N[C@@H](C)COC)cn1
InChIInChI=1S/C10H19N3O/c1-4-5-13-7-10(6-11-13)12-9(2)8-14-3/h6-7,9,12H,4-5,8H2,1-3H3/t9-/m0/s1
InChIKeyAIXJRNODTHVGPI-VIFPVBQESA-N
MW197.28 g/mol
LogP1.74
Rot. Bonds6

About N-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine

N-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine (PubChem CID 97338513) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is N-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine.

Molecular Properties

Compound NameN-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine
PubChem CID97338513
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC NameN-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine
SMILESCCCn1cc(N[C@@H](C)COC)cn1
InChIInChI=1S/C10H19N3O/c1-4-5-13-7-10(6-11-13)12-9(2)8-14-3/h6-7,9,12H,4-5,8H2,1-3H3/t9-/m0/s1
InChIKeyAIXJRNODTHVGPI-VIFPVBQESA-N
XLogP1.74
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-pentan-2-yl-1-propylpyrazol-4-amine
CID 115921377
N-[(2R)-4-methoxy-4-methylpentan-2-yl]-1-propylpyrazol-4-amine
CID 97338512
2-N-[1-(2-methoxyethyl)pyrazol-4-yl]propane-1,2-diamine
CID 103388669
1-(2-methoxyethyl)-N-(4-methylpentan-2-yl)pyrazol-4-amine
CID 43729075
2-[4-(1-methoxypropan-2-ylamino)pyrazol-1-yl]-N-methylacetamide
CID 62534727
1-propyl-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]pyrazol-4-amine
CID 97309859
N-(1-cyclopropylpropan-2-yl)-1-propylpyrazol-4-amine
CID 115921375
N-[(2R)-1-(3,4-difluorophenoxy)propan-2-yl]-1-propylpyrazol-4-amine
CID 97338534
1-propyl-N-[(2R)-4-pyrazol-1-ylbutan-2-yl]pyrazol-4-amine
CID 97342085
N-(1-cyclobutylpropan-2-yl)-1-propylpyrazol-4-amine
CID 115921376
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

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine?
The IUPAC name of N-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine (CID 97338513) is N-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine.
What is the SMILES notation for N-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine?
The canonical SMILES for N-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine is CCCn1cc(N[C@@H](C)COC)cn1.
What is the InChIKey of N-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine?
The InChIKey is AIXJRNODTHVGPI-VIFPVBQESA-N. The full InChI is InChI=1S/C10H19N3O/c1-4-5-13-7-10(6-11-13)12-9(2)8-14-3/h6-7,9,12H,4-5,8H2,1-3H3/t9-/m0/s1.
What are the key properties of N-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine?
N-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine has a molecular weight of 197.28 g/mol, XLogP of 1.74, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-methoxypropan-2-yl]-1-propylpyrazol-4-amine is sourced from PubChem (CID 97338513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).