(4-cyclopropyl-1-methylpyrazol-5-yl)methanamine

C8H13N3 — CID 105422577

IUPAC(4-cyclopropyl-1-methylpyrazol-5-yl)methanamine
SMILESCn1ncc(C2CC2)c1CN
InChIInChI=1S/C8H13N3/c1-11-8(4-9)7(5-10-11)6-2-3-6/h5-6H,2-4,9H2,1H3
InChIKeyFFKCXKUTCZAYDH-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.76
Rot. Bonds2

About (4-cyclopropyl-1-methylpyrazol-5-yl)methanamine

(4-cyclopropyl-1-methylpyrazol-5-yl)methanamine (PubChem CID 105422577) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is (4-cyclopropyl-1-methylpyrazol-5-yl)methanamine.

Molecular Properties

Compound Name(4-cyclopropyl-1-methylpyrazol-5-yl)methanamine
PubChem CID105422577
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name(4-cyclopropyl-1-methylpyrazol-5-yl)methanamine
SMILESCn1ncc(C2CC2)c1CN
InChIInChI=1S/C8H13N3/c1-11-8(4-9)7(5-10-11)6-2-3-6/h5-6H,2-4,9H2,1H3
InChIKeyFFKCXKUTCZAYDH-UHFFFAOYSA-N
XLogP0.76
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-cyclopropyl-1-methylpyrazol-5-yl)methanamine?
The IUPAC name of (4-cyclopropyl-1-methylpyrazol-5-yl)methanamine (CID 105422577) is (4-cyclopropyl-1-methylpyrazol-5-yl)methanamine.
What is the SMILES notation for (4-cyclopropyl-1-methylpyrazol-5-yl)methanamine?
The canonical SMILES for (4-cyclopropyl-1-methylpyrazol-5-yl)methanamine is Cn1ncc(C2CC2)c1CN.
What is the InChIKey of (4-cyclopropyl-1-methylpyrazol-5-yl)methanamine?
The InChIKey is FFKCXKUTCZAYDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-11-8(4-9)7(5-10-11)6-2-3-6/h5-6H,2-4,9H2,1H3.
What are the key properties of (4-cyclopropyl-1-methylpyrazol-5-yl)methanamine?
(4-cyclopropyl-1-methylpyrazol-5-yl)methanamine has a molecular weight of 151.21 g/mol, XLogP of 0.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropyl-1-methylpyrazol-5-yl)methanamine is sourced from PubChem (CID 105422577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).