3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine

C17H26N2 — CID 82733186

IUPAC3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine
SMILESCCc1cccnc1CNC1CCCC(C2CC2)C1
InChIInChI=1S/C17H26N2/c1-2-13-6-4-10-18-17(13)12-19-16-7-3-5-15(11-16)14-8-9-14/h4,6,10,14-16,19H,2-3,5,7-9,11-12H2,1H3
InChIKeyPRFKVNLNTCPTFS-UHFFFAOYSA-N
MW258.41 g/mol
LogP3.70
Rot. Bonds5

About 3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine

3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine (PubChem CID 82733186) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine
PubChem CID82733186
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine
SMILESCCc1cccnc1CNC1CCCC(C2CC2)C1
InChIInChI=1S/C17H26N2/c1-2-13-6-4-10-18-17(13)12-19-16-7-3-5-15(11-16)14-8-9-14/h4,6,10,14-16,19H,2-3,5,7-9,11-12H2,1H3
InChIKeyPRFKVNLNTCPTFS-UHFFFAOYSA-N
XLogP3.70
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine?
The IUPAC name of 3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine (CID 82733186) is 3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine?
The canonical SMILES for 3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine is CCc1cccnc1CNC1CCCC(C2CC2)C1.
What is the InChIKey of 3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine?
The InChIKey is PRFKVNLNTCPTFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-2-13-6-4-10-18-17(13)12-19-16-7-3-5-15(11-16)14-8-9-14/h4,6,10,14-16,19H,2-3,5,7-9,11-12H2,1H3.
What are the key properties of 3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine?
3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine has a molecular weight of 258.41 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[(3-ethyl-2-pyridinyl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 82733186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).