(2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide

C14H26N2O — CID 107569736

IUPAC(2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide
SMILESCCC[C@@H](N)C(=O)N(C)CC1CC2CCC1C2
InChIInChI=1S/C14H26N2O/c1-3-4-13(15)14(17)16(2)9-12-8-10-5-6-11(12)7-10/h10-13H,3-9,15H2,1-2H3/t10?,11?,12?,13-/m1/s1
InChIKeyFGLIJPSERDDWPN-NODFVKRRSA-N
MW238.37 g/mol
LogP2.01
Rot. Bonds5

About (2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide

(2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide (PubChem CID 107569736) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is (2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide
PubChem CID107569736
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name(2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide
SMILESCCC[C@@H](N)C(=O)N(C)CC1CC2CCC1C2
InChIInChI=1S/C14H26N2O/c1-3-4-13(15)14(17)16(2)9-12-8-10-5-6-11(12)7-10/h10-13H,3-9,15H2,1-2H3/t10?,11?,12?,13-/m1/s1
InChIKeyFGLIJPSERDDWPN-NODFVKRRSA-N
XLogP2.01
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylbutanamide
CID 63683674
(2S)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-4-methylsulfanylbutanamide
CID 63681786
N-(2-bicyclo[2.2.1]heptanylmethyl)-2-bromo-N-methylbutanamide
CID 63681740
(2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-3-phenylpropanamide
CID 63683339
2-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-N,4,4-trimethylpentanamide
CID 107472164
N-(2-bicyclo[2.2.1]heptanylmethyl)-2-[(Z)-N'-hydroxycarbamimidoyl]-N-methylbutanamide
CID 55231649
(2R)-2-amino-N-(cyclobutylmethyl)-N-methylpentanamide
CID 103796269
(2S)-2-amino-N-(cyclohexylmethyl)-N-methylpentanamide
CID 107568999
N-(2-bicyclo[2.2.1]heptanylmethyl)-2-cyano-N,3-dimethylbutanamide
CID 55233234
4-amino-1-(2-bicyclo[2.2.1]heptanyl)heptan-2-one
CID 116607768
2-amino-N-methyl-N-(oxolan-3-ylmethyl)pentanamide;hydrochloride
CID 119341303
3-[2-bicyclo[2.2.1]heptanylmethyl(methyl)amino]-3-oxopropanoic acid
CID 63685758

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide?
The IUPAC name of (2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide (CID 107569736) is (2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide.
What is the SMILES notation for (2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide?
The canonical SMILES for (2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide is CCC[C@@H](N)C(=O)N(C)CC1CC2CCC1C2.
What is the InChIKey of (2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide?
The InChIKey is FGLIJPSERDDWPN-NODFVKRRSA-N. The full InChI is InChI=1S/C14H26N2O/c1-3-4-13(15)14(17)16(2)9-12-8-10-5-6-11(12)7-10/h10-13H,3-9,15H2,1-2H3/t10?,11?,12?,13-/m1/s1.
What are the key properties of (2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide?
(2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide has a molecular weight of 238.37 g/mol, XLogP of 2.01, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide is sourced from PubChem (CID 107569736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).