3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine

C12H15N3O — CID 122168879

IUPAC3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine
SMILESCn1nc(C2CC2)cc1NCc1ccco1
InChIInChI=1S/C12H15N3O/c1-15-12(7-11(14-15)9-4-5-9)13-8-10-3-2-6-16-10/h2-3,6-7,9,13H,4-5,8H2,1H3
InChIKeyQBGAETIUCPWQEX-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.50
Rot. Bonds4

About 3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine

3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine (PubChem CID 122168879) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine
PubChem CID122168879
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine
SMILESCn1nc(C2CC2)cc1NCc1ccco1
InChIInChI=1S/C12H15N3O/c1-15-12(7-11(14-15)9-4-5-9)13-8-10-3-2-6-16-10/h2-3,6-7,9,13H,4-5,8H2,1H3
InChIKeyQBGAETIUCPWQEX-UHFFFAOYSA-N
XLogP2.50
TPSA42.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-N-(furan-2-ylmethyl)-5-methylpyrazol-3-amine
CID 122168955
N-[(3-cyclopropyl-1,2-oxazol-5-yl)methyl]-1-(furan-2-yl)methanamine
CID 146137708
3-cyclobutyl-N-(2,2-dimethylpropyl)-1-methylpyrazol-5-amine
CID 115702975
3-cyclopropyl-1-methyl-N-[[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]methyl]pyrazol-5-amine
CID 122167900
N-(3-cyclopropyl-1-phenylpyrazol-5-yl)-2-[[5-(furan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide
CID 24675301
(3-cyclopropyl-1-methylpyrazol-5-yl)carbamic acid
CID 69157729
2-[5-cyclopropyl-3-(difluoromethyl)pyrazol-1-yl]-N-(furan-2-ylmethyl)acetamide
CID 19520335
5-(furan-2-ylmethylamino)-1,3-dimethylpyrazole-4-carbonitrile
CID 63756975
methyl N-(3-cyclopropyl-1-methylpyrazol-5-yl)carbamate
CID 134798076
6-butoxy-2-cyclopropyl-N-(furan-2-ylmethyl)pyrimidin-4-amine
CID 82456516
6-cyclopropyl-N-(furan-2-ylmethyl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 17393292
N-(furan-2-ylmethyl)pyrimidin-2-amine
CID 28514232

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine?
The IUPAC name of 3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine (CID 122168879) is 3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine.
What is the SMILES notation for 3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine?
The canonical SMILES for 3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine is Cn1nc(C2CC2)cc1NCc1ccco1.
What is the InChIKey of 3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine?
The InChIKey is QBGAETIUCPWQEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-15-12(7-11(14-15)9-4-5-9)13-8-10-3-2-6-16-10/h2-3,6-7,9,13H,4-5,8H2,1H3.
What are the key properties of 3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine?
3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine has a molecular weight of 217.27 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-(furan-2-ylmethyl)-1-methylpyrazol-5-amine is sourced from PubChem (CID 122168879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).