4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine

C15H27N3 — CID 114555631

IUPAC4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine
SMILESCCCn1nccc1CNC1CCC(CC)CC1
InChIInChI=1S/C15H27N3/c1-3-11-18-15(9-10-17-18)12-16-14-7-5-13(4-2)6-8-14/h9-10,13-14,16H,3-8,11-12H2,1-2H3
InChIKeyKMEBDBZATGWSLG-UHFFFAOYSA-N
MW249.40 g/mol
LogP3.35
Rot. Bonds6

About 4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine

4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine (PubChem CID 114555631) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine
PubChem CID114555631
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine
SMILESCCCn1nccc1CNC1CCC(CC)CC1
InChIInChI=1S/C15H27N3/c1-3-11-18-15(9-10-17-18)12-16-14-7-5-13(4-2)6-8-14/h9-10,13-14,16H,3-8,11-12H2,1-2H3
InChIKeyKMEBDBZATGWSLG-UHFFFAOYSA-N
XLogP3.35
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-propyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine
CID 114555646
3,3-dimethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclopentan-1-amine
CID 114556221
N-[[2-(3-ethoxypropyl)pyrazol-3-yl]methyl]cyclopropanamine
CID 65178386
4-ethyl-1-[[(2-propylpyrazol-3-yl)methylamino]methyl]cyclohexan-1-ol
CID 114555851
2,2-diethyl-N-[(2-propylpyrazol-3-yl)methyl]oxan-4-amine
CID 114556046
N-[(2-ethylpyrazol-3-yl)methyl]-1-methylpiperidin-3-amine
CID 115762067
N-[[2-[2-(4-methoxyphenyl)ethyl]pyrazol-3-yl]methyl]cyclopropanamine
CID 65441861
4-N-[(2-methylpyrazol-3-yl)methyl]cyclohexane-1,4-diamine
CID 62320335
N-[(2-propylpyrazol-3-yl)methyl]hydroxylamine
CID 114556004
N-[(2-ethylpyrazol-3-yl)methyl]-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 114555002
2-cyclopropyl-N-[(2-propylpyrazol-3-yl)methyl]propan-1-amine
CID 114556145
1-(2-ethylpyrazol-3-yl)-N-[(2-propylpyrazol-3-yl)methyl]methanamine
CID 19625523

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine (CID 114555631) is 4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine is CCCn1nccc1CNC1CCC(CC)CC1.
What is the InChIKey of 4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine?
The InChIKey is KMEBDBZATGWSLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-3-11-18-15(9-10-17-18)12-16-14-7-5-13(4-2)6-8-14/h9-10,13-14,16H,3-8,11-12H2,1-2H3.
What are the key properties of 4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine?
4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine has a molecular weight of 249.40 g/mol, XLogP of 3.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[(2-propylpyrazol-3-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 114555631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).