2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide

C14H26N2O — CID 63684003

IUPAC2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide
SMILESCCCCC(N)C(=O)NCC1CC2CCC1C2
InChIInChI=1S/C14H26N2O/c1-2-3-4-13(15)14(17)16-9-12-8-10-5-6-11(12)7-10/h10-13H,2-9,15H2,1H3,(H,16,17)
InChIKeyFKBOKNNFZJFRQK-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.06
Rot. Bonds6

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

2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide (PubChem CID 63684003) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide.

Molecular Properties

Compound Name2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide
PubChem CID63684003
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide
SMILESCCCCC(N)C(=O)NCC1CC2CCC1C2
InChIInChI=1S/C14H26N2O/c1-2-3-4-13(15)14(17)16-9-12-8-10-5-6-11(12)7-10/h10-13H,2-9,15H2,1H3,(H,16,17)
InChIKeyFKBOKNNFZJFRQK-UHFFFAOYSA-N
XLogP2.06
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-5-(2-bicyclo[2.2.1]heptanylmethylamino)-5-oxopentanoic acid
CID 64888968
N-(2-bicyclo[2.2.1]heptanylmethyl)-2-chloropropanamide
CID 63683466
(2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-3-phenylpropanamide
CID 63683495
2-amino-N-[(3-hydroxycyclopentyl)methyl]hexanamide
CID 106134012
(2S)-2-amino-N-(thiolan-3-ylmethyl)hexanamide
CID 107296121
1-[[(1R,2R,4S)-2-bicyclo[2.2.1]heptanyl]methyl]-3-ethylurea
CID 27276337
2-amino-N-[(3-hydroxycyclohexyl)methyl]hexanamide
CID 103950314
2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-phenylacetamide
CID 55232631
(2S)-2-amino-N-(2-cyclopropylethyl)hexanamide
CID 103831775
(2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide
CID 113304839
(2R)-2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylpentanamide
CID 107569736
(2S)-2-amino-N-(2,2-dicyclopropylethyl)hexanamide
CID 113304830

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide?
The IUPAC name of 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide (CID 63684003) is 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide.
What is the SMILES notation for 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide?
The canonical SMILES for 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide is CCCCC(N)C(=O)NCC1CC2CCC1C2.
What is the InChIKey of 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide?
The InChIKey is FKBOKNNFZJFRQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-2-3-4-13(15)14(17)16-9-12-8-10-5-6-11(12)7-10/h10-13H,2-9,15H2,1H3,(H,16,17).
What are the key properties of 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide?
2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide has a molecular weight of 238.37 g/mol, XLogP of 2.06, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)hexanamide is sourced from PubChem (CID 63684003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).