1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine

C9H13N5 — CID 129387731

IUPAC1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine
SMILESC[C@H](c1cnn(C)c1)n1cc(N)cn1
InChIInChI=1S/C9H13N5/c1-7(8-3-11-13(2)5-8)14-6-9(10)4-12-14/h3-7H,10H2,1-2H3/t7-/m1/s1
InChIKeyREPVVYQSBBHADQ-SSDOTTSWSA-N
MW191.24 g/mol
LogP0.81
Rot. Bonds2

About 1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine

1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine (PubChem CID 129387731) has the molecular formula C9H13N5 and a molecular weight of 191.24 g/mol. Its IUPAC name is 1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine.

Molecular Properties

Compound Name1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine
PubChem CID129387731
Molecular FormulaC9H13N5
Molecular Weight191.24 g/mol
Exact Mass191.12
IUPAC Name1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine
SMILESC[C@H](c1cnn(C)c1)n1cc(N)cn1
InChIInChI=1S/C9H13N5/c1-7(8-3-11-13(2)5-8)14-6-9(10)4-12-14/h3-7H,10H2,1-2H3/t7-/m1/s1
InChIKeyREPVVYQSBBHADQ-SSDOTTSWSA-N
XLogP0.81
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.24
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-propan-2-ylpyrazol-4-amine;dihydrochloride
CID 122360212
1-[1-(6-methoxy-3-pyridinyl)ethyl]pyrazol-4-amine
CID 90037704
(1R)-1-(1-methylpyrazol-4-yl)ethane-1,2-diamine
CID 93094324
1-[5-[1-(4-aminopyrazol-1-yl)ethyl]-2-pyridinyl]propan-2-ol
CID 175973967
1-[1-[bis(sulfanyl)amino]ethyl]pyrazol-4-amine
CID 90037916
4-[1-(4-chloropyrazol-1-yl)ethyl]aniline
CID 61263528
1-[(2R)-pentan-2-yl]pyrazol-4-amine
CID 95212149
(3R)-3-amino-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 94420132
3-(4-aminopyrazol-1-yl)butanenitrile
CID 51000310
1-amino-1-(1-methylpyrazol-4-yl)butan-2-ol
CID 82412738
(2S)-2-amino-2-(1-methylpyrazol-4-yl)ethanol
CID 93471722
1-(1-methylpyrazol-4-yl)pyrazol-4-amine;dihydrochloride
CID 163336294

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine?
The IUPAC name of 1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine (CID 129387731) is 1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine.
What is the SMILES notation for 1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine?
The canonical SMILES for 1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine is C[C@H](c1cnn(C)c1)n1cc(N)cn1.
What is the InChIKey of 1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine?
The InChIKey is REPVVYQSBBHADQ-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H13N5/c1-7(8-3-11-13(2)5-8)14-6-9(10)4-12-14/h3-7H,10H2,1-2H3/t7-/m1/s1.
What are the key properties of 1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine?
1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine has a molecular weight of 191.24 g/mol, XLogP of 0.81, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-(1-methylpyrazol-4-yl)ethyl]pyrazol-4-amine is sourced from PubChem (CID 129387731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).