N-(1-amino-3-methylpentan-3-yl)nonanamide

C15H32N2O — CID 106164392

IUPACN-(1-amino-3-methylpentan-3-yl)nonanamide
SMILESCCCCCCCCC(=O)NC(C)(CC)CCN
InChIInChI=1S/C15H32N2O/c1-4-6-7-8-9-10-11-14(18)17-15(3,5-2)12-13-16/h4-13,16H2,1-3H3,(H,17,18)
InChIKeyNBLJWHNIWOQEKN-UHFFFAOYSA-N
MW256.43 g/mol
LogP3.37
Rot. Bonds11

About N-(1-amino-3-methylpentan-3-yl)nonanamide

N-(1-amino-3-methylpentan-3-yl)nonanamide (PubChem CID 106164392) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is N-(1-amino-3-methylpentan-3-yl)nonanamide.

Molecular Properties

Compound NameN-(1-amino-3-methylpentan-3-yl)nonanamide
PubChem CID106164392
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC NameN-(1-amino-3-methylpentan-3-yl)nonanamide
SMILESCCCCCCCCC(=O)NC(C)(CC)CCN
InChIInChI=1S/C15H32N2O/c1-4-6-7-8-9-10-11-14(18)17-15(3,5-2)12-13-16/h4-13,16H2,1-3H3,(H,17,18)
InChIKeyNBLJWHNIWOQEKN-UHFFFAOYSA-N
XLogP3.37
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 53.37
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

N-(3-methylpentan-3-yl)hexanamide
CID 90883485
N-(1-bromo-2-methylbutan-2-yl)nonanamide
CID 114314390
N-(1-bromo-2-methylbutan-2-yl)hexanamide
CID 114314353
N-[1,7-diamino-4-(3-aminopropyl)heptan-4-yl]dodecanamide;trihydrochloride
CID 24905581
N-(1-amino-3-hydroxyhexan-3-yl)dodecanamide
CID 87068240
N-(1-amino-2,4-dimethylpentan-2-yl)heptanamide
CID 115737471
N-(2-hydroxypropan-2-yl)heptanamide
CID 139307065
N-[3-(aminomethyl)pentan-3-yl]octanamide
CID 63767635
N-(1-amino-2,3-dimethylbutan-2-yl)octanamide
CID 81486540
N-(1-amino-2,3-dimethylbutan-2-yl)decanamide
CID 115310393
4-(6-aminohexanoylamino)-4-methylheptanedioic acid
CID 146234237
N-(1-amino-3-methylpentan-3-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 106164834

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-3-methylpentan-3-yl)nonanamide?
The IUPAC name of N-(1-amino-3-methylpentan-3-yl)nonanamide (CID 106164392) is N-(1-amino-3-methylpentan-3-yl)nonanamide.
What is the SMILES notation for N-(1-amino-3-methylpentan-3-yl)nonanamide?
The canonical SMILES for N-(1-amino-3-methylpentan-3-yl)nonanamide is CCCCCCCCC(=O)NC(C)(CC)CCN.
What is the InChIKey of N-(1-amino-3-methylpentan-3-yl)nonanamide?
The InChIKey is NBLJWHNIWOQEKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-4-6-7-8-9-10-11-14(18)17-15(3,5-2)12-13-16/h4-13,16H2,1-3H3,(H,17,18).
What are the key properties of N-(1-amino-3-methylpentan-3-yl)nonanamide?
N-(1-amino-3-methylpentan-3-yl)nonanamide has a molecular weight of 256.43 g/mol, XLogP of 3.37, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-3-methylpentan-3-yl)nonanamide is sourced from PubChem (CID 106164392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).