3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine

C14H25N3 — CID 114556221

IUPAC3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine
SMILESCCCn1nccc1CNC1CCC(C)(C)C1
InChIInChI=1S/C14H25N3/c1-4-9-17-13(6-8-16-17)11-15-12-5-7-14(2,3)10-12/h6,8,12,15H,4-5,7,9-11H2,1-3H3
InChIKeyWXJCNTMLPNJYNV-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.96
Rot. Bonds5

About 3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine

3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine (PubChem CID 114556221) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is 3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine
PubChem CID114556221
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC Name3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine
SMILESCCCn1nccc1CNC1CCC(C)(C)C1
InChIInChI=1S/C14H25N3/c1-4-9-17-13(6-8-16-17)11-15-12-5-7-14(2,3)10-12/h6,8,12,15H,4-5,7,9-11H2,1-3H3
InChIKeyWXJCNTMLPNJYNV-UHFFFAOYSA-N
XLogP2.96
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-diethyl-N-[(2-propylpyrazol-3-yl)methyl]oxan-4-amine
CID 114556046
4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine
CID 114555631
4-propyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine
CID 114555646
1-methyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine
CID 114555624
3,3-dimethyl-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]cyclopentan-1-amine
CID 104531281
N-[[4,4-dimethyl-2-(2-propylpyrazol-3-yl)cyclohexyl]methyl]cyclopropanamine
CID 81022983
2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine
CID 114556145
N-[[2-(3-ethoxypropyl)pyrazol-3-yl]methyl]cyclopropanamine
CID 65178386
N-[(5-ethylfuran-2-yl)methyl]-3,3-dimethylcyclopentan-1-amine
CID 115881484
N-[(2-propylpyrazol-3-yl)methyl]hydroxylamine
CID 114556004
N-[(1,4-dimethylpiperidin-4-yl)methyl]-1-(2-propylpyrazol-3-yl)methanamine
CID 107163325
N-[[2-(2-fluoroethyl)pyrazol-3-yl]methyl]-1-(2-propylpyrazol-3-yl)methanamine
CID 122166952

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine?
The IUPAC name of 3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine (CID 114556221) is 3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine?
The canonical SMILES for 3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine is CCCn1nccc1CNC1CCC(C)(C)C1.
What is the InChIKey of 3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine?
The InChIKey is WXJCNTMLPNJYNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-4-9-17-13(6-8-16-17)11-15-12-5-7-14(2,3)10-12/h6,8,12,15H,4-5,7,9-11H2,1-3H3.
What are the key properties of 3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine?
3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine has a molecular weight of 235.37 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 114556221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).