1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine

C9H15N3O — CID 105439556

IUPAC1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine
SMILESCC(C)n1nc(N)c2c1CCOC2
InChIInChI=1S/C9H15N3O/c1-6(2)12-8-3-4-13-5-7(8)9(10)11-12/h6H,3-5H2,1-2H3,(H2,10,11)
InChIKeyCEQHLJDLASWKJY-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.12
Rot. Bonds1

About 1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine

1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine (PubChem CID 105439556) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine.

Molecular Properties

Compound Name1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine
PubChem CID105439556
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine
SMILESCC(C)n1nc(N)c2c1CCOC2
InChIInChI=1S/C9H15N3O/c1-6(2)12-8-3-4-13-5-7(8)9(10)11-12/h6H,3-5H2,1-2H3,(H2,10,11)
InChIKeyCEQHLJDLASWKJY-UHFFFAOYSA-N
XLogP1.12
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Launch Full Analysis

Related Compounds

(1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-yl)methanamine
CID 105449261
1-propan-2-yl-4,5,6,7-tetrahydroindazol-3-amine
CID 83862378
1-propan-2-yl-5,7-dihydro-4H-pyrano[4,3-d]pyrazole-3-carbaldehyde
CID 112711170
1-(2-tert-butylphenyl)-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine
CID 102942928
3-(chloromethyl)-2-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazole
CID 121214424
1-(5-methyl-3-pyridinyl)-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine
CID 107587248
1-(2,5-dichloro-4-methylphenyl)-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine
CID 102943085
1-(oxan-4-yl)-5,7-dihydro-4H-pyrano[4,3-d]pyrazol-3-amine
CID 105480660
N-[(5-methylfuran-2-yl)methyl]-3-(1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-yl)propanamide
CID 154578923
2-(2-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-yl)acetic acid
CID 121214446
N-[(4-morpholin-4-ylphenyl)methyl]-3-(1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-yl)propanamide
CID 154578957
1-propan-2-yl-4,6-dihydrofuro[3,4-d]pyrazole-3-carboxylic acid
CID 90162209

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine?
The IUPAC name of 1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine (CID 105439556) is 1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine.
What is the SMILES notation for 1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine?
The canonical SMILES for 1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine is CC(C)n1nc(N)c2c1CCOC2.
What is the InChIKey of 1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine?
The InChIKey is CEQHLJDLASWKJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-6(2)12-8-3-4-13-5-7(8)9(10)11-12/h6H,3-5H2,1-2H3,(H2,10,11).
What are the key properties of 1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine?
1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine has a molecular weight of 181.24 g/mol, XLogP of 1.12, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-amine is sourced from PubChem (CID 105439556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).