(2R)-2-amino-N-tetradecylbutanamide

C18H38N2O — CID 158842614

IUPAC(2R)-2-amino-N-tetradecylbutanamide
SMILESCCCCCCCCCCCCCCNC(=O)[C@H](N)CC
InChIInChI=1S/C18H38N2O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-20-18(21)17(19)4-2/h17H,3-16,19H2,1-2H3,(H,20,21)/t17-/m1/s1
InChIKeyCJACSSKQLQURTF-QGZVFWFLSA-N
MW298.51 g/mol
LogP4.54
Rot. Bonds15

About (2R)-2-amino-N-tetradecylbutanamide

(2R)-2-amino-N-tetradecylbutanamide (PubChem CID 158842614) has the molecular formula C18H38N2O and a molecular weight of 298.51 g/mol. Its IUPAC name is (2R)-2-amino-N-tetradecylbutanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-tetradecylbutanamide
PubChem CID158842614
Molecular FormulaC18H38N2O
Molecular Weight298.51 g/mol
Exact Mass298.30
IUPAC Name(2R)-2-amino-N-tetradecylbutanamide
SMILESCCCCCCCCCCCCCCNC(=O)[C@H](N)CC
InChIInChI=1S/C18H38N2O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-20-18(21)17(19)4-2/h17H,3-16,19H2,1-2H3,(H,20,21)/t17-/m1/s1
InChIKeyCJACSSKQLQURTF-QGZVFWFLSA-N
XLogP4.54
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.51
LogP ≤ 54.54
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

2-amino-N-hexylhexanamide
CID 60852762
2,3-diamino-N-octadecylpropanamide
CID 158457421
(2R)-2-amino-3-hydroxy-N-octylpropanamide
CID 82675053
(2S)-2-amino-N-dodecylhexanamide;hydrochloride
CID 135364190
(3S)-3-amino-4-(dodecylamino)-4-oxobutanoic acid
CID 87318913
(3S)-3-amino-4-(octadecylamino)-4-oxobutanoic acid
CID 87319026
(3S)-3-amino-4-(nonylamino)-4-oxobutanoic acid
CID 87588686
2-amino-3-chloro-N-pentylpropanamide
CID 18966849
(2S)-2,6-diamino-N-hexadecylhexanamide
CID 10595298
(2R)-2,6-diamino-N-dodecylhexanamide
CID 10663029
(2S)-2-amino-3-methyl-N-octadecylpentanamide
CID 58604652
2-amino-N-octadecyl-5-oxotetracosanamide
CID 161320557

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-tetradecylbutanamide?
The IUPAC name of (2R)-2-amino-N-tetradecylbutanamide (CID 158842614) is (2R)-2-amino-N-tetradecylbutanamide.
What is the SMILES notation for (2R)-2-amino-N-tetradecylbutanamide?
The canonical SMILES for (2R)-2-amino-N-tetradecylbutanamide is CCCCCCCCCCCCCCNC(=O)[C@H](N)CC.
What is the InChIKey of (2R)-2-amino-N-tetradecylbutanamide?
The InChIKey is CJACSSKQLQURTF-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H38N2O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-20-18(21)17(19)4-2/h17H,3-16,19H2,1-2H3,(H,20,21)/t17-/m1/s1.
What are the key properties of (2R)-2-amino-N-tetradecylbutanamide?
(2R)-2-amino-N-tetradecylbutanamide has a molecular weight of 298.51 g/mol, XLogP of 4.54, 15 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-tetradecylbutanamide is sourced from PubChem (CID 158842614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).