6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide

C14H29N3O — CID 65291413

IUPAC6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide
SMILESCC(N)CCCC(C)C(=O)NC1CCC(N)CC1
InChIInChI=1S/C14H29N3O/c1-10(4-3-5-11(2)15)14(18)17-13-8-6-12(16)7-9-13/h10-13H,3-9,15-16H2,1-2H3,(H,17,18)
InChIKeyYGZXYWOFHOPHIW-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.53
Rot. Bonds6

About 6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide

6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide (PubChem CID 65291413) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide.

Molecular Properties

Compound Name6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide
PubChem CID65291413
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide
SMILESCC(N)CCCC(C)C(=O)NC1CCC(N)CC1
InChIInChI=1S/C14H29N3O/c1-10(4-3-5-11(2)15)14(18)17-13-8-6-12(16)7-9-13/h10-13H,3-9,15-16H2,1-2H3,(H,17,18)
InChIKeyYGZXYWOFHOPHIW-UHFFFAOYSA-N
XLogP1.53
TPSA81.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-2-methyl-N-(oxan-4-yl)heptanamide
CID 65290448
6-amino-N-(1-ethylpiperidin-4-yl)-2-methylheptanamide
CID 65292005
5-amino-N-cyclopropylhexanamide
CID 82848782
6-amino-N-(dicyclopropylmethyl)-2-methylheptanamide
CID 65291779
2-amino-N-(4-aminocyclohexyl)pentanamide
CID 62319442
N-(4-aminocyclohexyl)-2-(carbamoylamino)hexanamide
CID 119475285
N-(4-aminocyclohexyl)-2-ethoxypropanamide
CID 119478328
6-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylheptanamide
CID 114629788
2-[(6-amino-2-methylheptanoyl)amino]-1-methylcyclohexane-1-carboxylic acid
CID 83209774
1-(6-amino-2-methylheptanoyl)-N-cyclopropylpyrrolidine-2-carboxamide
CID 65290967
6-amino-2-methyl-N-(3-methylbutyl)heptanamide
CID 65293191
6-amino-2-methyl-N-propylheptanamide
CID 65292773

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide?
The IUPAC name of 6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide (CID 65291413) is 6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide.
What is the SMILES notation for 6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide?
The canonical SMILES for 6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide is CC(N)CCCC(C)C(=O)NC1CCC(N)CC1.
What is the InChIKey of 6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide?
The InChIKey is YGZXYWOFHOPHIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-10(4-3-5-11(2)15)14(18)17-13-8-6-12(16)7-9-13/h10-13H,3-9,15-16H2,1-2H3,(H,17,18).
What are the key properties of 6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide?
6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide has a molecular weight of 255.41 g/mol, XLogP of 1.53, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(4-aminocyclohexyl)-2-methylheptanamide is sourced from PubChem (CID 65291413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).