(2R)-N-cyclohexyl-2-(hexylamino)propanamide

C15H30N2O — CID 95357979

IUPAC(2R)-N-cyclohexyl-2-(hexylamino)propanamide
SMILESCCCCCCN[C@H](C)C(=O)NC1CCCCC1
InChIInChI=1S/C15H30N2O/c1-3-4-5-9-12-16-13(2)15(18)17-14-10-7-6-8-11-14/h13-14,16H,3-12H2,1-2H3,(H,17,18)/t13-/m1/s1
InChIKeyQONZRBCOLSTFBG-CYBMUJFWSA-N
MW254.42 g/mol
LogP2.99
Rot. Bonds8

About (2R)-N-cyclohexyl-2-(hexylamino)propanamide

(2R)-N-cyclohexyl-2-(hexylamino)propanamide (PubChem CID 95357979) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is (2R)-N-cyclohexyl-2-(hexylamino)propanamide.

Molecular Properties

Compound Name(2R)-N-cyclohexyl-2-(hexylamino)propanamide
PubChem CID95357979
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name(2R)-N-cyclohexyl-2-(hexylamino)propanamide
SMILESCCCCCCN[C@H](C)C(=O)NC1CCCCC1
InChIInChI=1S/C15H30N2O/c1-3-4-5-9-12-16-13(2)15(18)17-14-10-7-6-8-11-14/h13-14,16H,3-12H2,1-2H3,(H,17,18)/t13-/m1/s1
InChIKeyQONZRBCOLSTFBG-CYBMUJFWSA-N
XLogP2.99
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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CID 43083458
2-(3-butoxypropylamino)-N-cyclohexylpropanamide
CID 115569811
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CID 115600082
N-cyclopropyl-2-(6-hydroxyhexylamino)propanamide
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(2S)-N-cyclopentyl-2-(pentylcarbamoylamino)propanamide
CID 94782979
N-cyclohexyl-2-[(5-hydroxy-4-methylpentyl)amino]propanamide
CID 106160233
N-cyclohexyl-2-(pent-4-ynylamino)propanamide
CID 103711279
N-cyclohexyl-2-(2-ethoxyethylamino)propanamide
CID 43591067
N-(1-cyclohexylethyl)decan-1-amine
CID 55195239
N-[(1S)-1-cyclohexylethyl]heptan-1-amine
CID 81387571
N-[(1R)-1-cyclohexylethyl]hexan-1-amine
CID 81384209
(2S)-N-cyclopentyl-2-(2-propan-2-ylsulfanylethylamino)propanamide
CID 95125590

Frequently Asked Questions

What is the IUPAC name of (2R)-N-cyclohexyl-2-(hexylamino)propanamide?
The IUPAC name of (2R)-N-cyclohexyl-2-(hexylamino)propanamide (CID 95357979) is (2R)-N-cyclohexyl-2-(hexylamino)propanamide.
What is the SMILES notation for (2R)-N-cyclohexyl-2-(hexylamino)propanamide?
The canonical SMILES for (2R)-N-cyclohexyl-2-(hexylamino)propanamide is CCCCCCN[C@H](C)C(=O)NC1CCCCC1.
What is the InChIKey of (2R)-N-cyclohexyl-2-(hexylamino)propanamide?
The InChIKey is QONZRBCOLSTFBG-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-4-5-9-12-16-13(2)15(18)17-14-10-7-6-8-11-14/h13-14,16H,3-12H2,1-2H3,(H,17,18)/t13-/m1/s1.
What are the key properties of (2R)-N-cyclohexyl-2-(hexylamino)propanamide?
(2R)-N-cyclohexyl-2-(hexylamino)propanamide has a molecular weight of 254.42 g/mol, XLogP of 2.99, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-cyclohexyl-2-(hexylamino)propanamide is sourced from PubChem (CID 95357979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).