N-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine

C10H17N3 — CID 64505429

IUPACN-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine
SMILESCNC1CCC(c2cnn(C)c2)C1
InChIInChI=1S/C10H17N3/c1-11-10-4-3-8(5-10)9-6-12-13(2)7-9/h6-8,10-11H,3-5H2,1-2H3
InChIKeyIPRSRJKVXKACBX-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.28
Rot. Bonds2

About N-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine

N-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine (PubChem CID 64505429) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine
PubChem CID64505429
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine
SMILESCNC1CCC(c2cnn(C)c2)C1
InChIInChI=1S/C10H17N3/c1-11-10-4-3-8(5-10)9-6-12-13(2)7-9/h6-8,10-11H,3-5H2,1-2H3
InChIKeyIPRSRJKVXKACBX-UHFFFAOYSA-N
XLogP1.28
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine?
The IUPAC name of N-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine (CID 64505429) is N-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine.
What is the SMILES notation for N-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine?
The canonical SMILES for N-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine is CNC1CCC(c2cnn(C)c2)C1.
What is the InChIKey of N-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine?
The InChIKey is IPRSRJKVXKACBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-11-10-4-3-8(5-10)9-6-12-13(2)7-9/h6-8,10-11H,3-5H2,1-2H3.
What are the key properties of N-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine?
N-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine has a molecular weight of 179.27 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(1-methylpyrazol-4-yl)cyclopentan-1-amine is sourced from PubChem (CID 64505429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).