1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine

C7H11N5 — CID 136922884

IUPAC1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine
SMILESCC(N)Cc1nc2[nH]ncc2[nH]1
InChIInChI=1S/C7H11N5/c1-4(8)2-6-10-5-3-9-12-7(5)11-6/h3-4H,2,8H2,1H3,(H2,9,10,11,12)
InChIKeyAFTILQFUPHGROQ-UHFFFAOYSA-N
MW165.20 g/mol
LogP0.18
Rot. Bonds2

About 1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine

1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine (PubChem CID 136922884) has the molecular formula C7H11N5 and a molecular weight of 165.20 g/mol. Its IUPAC name is 1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine.

Molecular Properties

Compound Name1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine
PubChem CID136922884
Molecular FormulaC7H11N5
Molecular Weight165.20 g/mol
Exact Mass165.10
IUPAC Name1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine
SMILESCC(N)Cc1nc2[nH]ncc2[nH]1
InChIInChI=1S/C7H11N5/c1-4(8)2-6-10-5-3-9-12-7(5)11-6/h3-4H,2,8H2,1H3,(H2,9,10,11,12)
InChIKeyAFTILQFUPHGROQ-UHFFFAOYSA-N
XLogP0.18
TPSA83.38 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 50.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-1-(1H-indazol-5-yl)propan-2-amine
CID 146673459
5-(2-aminopropyl)-1H-1,2,4-triazol-3-amine
CID 61319976
5-(2-aminopropyl)-N-methyl-1H-1,2,4-triazol-3-amine
CID 83872825
1-(3-methoxy-1H-1,2,4-triazol-5-yl)propan-2-amine
CID 83872862
1-(3-propan-2-yl-1H-1,2,4-triazol-5-yl)propan-2-amine
CID 61337752
1-(5-bromo-1H-imidazol-2-yl)propan-2-amine
CID 83881752
(E,2S)-5-(1H-pyrazolo[5,4-b]pyridin-5-yl)pent-4-en-2-amine;trihydrochloride
CID 178024066
1-(4-chloro-1H-pyrazol-5-yl)propan-2-amine;hydrochloride
CID 170893702
(E,2S)-5-(1H-pyrazolo[3,4-b]pyrazin-5-yl)pent-4-en-2-amine
CID 178024186
1-[5-(2-fluoropropan-2-yl)-1H-imidazol-2-yl]propan-2-amine
CID 84769786
N-(3-aminobutyl)-1H-indazole-6-carboxamide
CID 63253437
1-[4-(1,1-difluoroethyl)-5-methyl-1H-imidazol-2-yl]propan-2-amine
CID 84777157

Frequently Asked Questions

What is the IUPAC name of 1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine?
The IUPAC name of 1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine (CID 136922884) is 1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine.
What is the SMILES notation for 1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine?
The canonical SMILES for 1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine is CC(N)Cc1nc2[nH]ncc2[nH]1.
What is the InChIKey of 1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine?
The InChIKey is AFTILQFUPHGROQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N5/c1-4(8)2-6-10-5-3-9-12-7(5)11-6/h3-4H,2,8H2,1H3,(H2,9,10,11,12).
What are the key properties of 1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine?
1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine has a molecular weight of 165.20 g/mol, XLogP of 0.18, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,4-dihydroimidazo[4,5-d]pyrazol-5-yl)propan-2-amine is sourced from PubChem (CID 136922884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).