N,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide

C17H36N2O — CID 43675030

IUPACN,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide
SMILESCCCCCCCC(C)NC(CC(C)C)C(=O)N(C)C
InChIInChI=1S/C17H36N2O/c1-7-8-9-10-11-12-15(4)18-16(13-14(2)3)17(20)19(5)6/h14-16,18H,7-13H2,1-6H3
InChIKeyTVCBGQDHJPBAPN-UHFFFAOYSA-N
MW284.49 g/mol
LogP3.83
Rot. Bonds11

About N,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide

N,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide (PubChem CID 43675030) has the molecular formula C17H36N2O and a molecular weight of 284.49 g/mol. Its IUPAC name is N,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide.

Molecular Properties

Compound NameN,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide
PubChem CID43675030
Molecular FormulaC17H36N2O
Molecular Weight284.49 g/mol
Exact Mass284.28
IUPAC NameN,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide
SMILESCCCCCCCC(C)NC(CC(C)C)C(=O)N(C)C
InChIInChI=1S/C17H36N2O/c1-7-8-9-10-11-12-15(4)18-16(13-14(2)3)17(20)19(5)6/h14-16,18H,7-13H2,1-6H3
InChIKeyTVCBGQDHJPBAPN-UHFFFAOYSA-N
XLogP3.83
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.49
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2R)-N,N-dimethyl-2-[[(2S)-octan-2-yl]carbamoylamino]propanamide
CID 97027546
N,N,4-trimethyl-2-(2-methylpentan-3-ylamino)pentanamide
CID 43779357
N-tetradecan-2-yltetradecan-2-amine
CID 20841578
(2S)-2-(heptadecan-2-ylamino)pentanedioic acid
CID 121284331
2-(nonan-2-ylamino)propanoic acid
CID 61499682
ethyl 2-(heptan-2-ylamino)butanoate
CID 64668767
2,4-dimethyl-N-pentadecan-8-ylpentanamide
CID 135127559
(2R)-2-[[(2R)-heptan-2-yl]sulfamoyl]-N,N-dimethylpropanamide
CID 99796865
1-(pentadecan-2-ylamino)ethanol
CID 90985657
(2S)-2-amino-4-methyl-N-octan-2-ylpentanamide
CID 61179526
N-(3-methylbutyl)-2-(octan-2-ylamino)propanamide
CID 61476708
N-dodecan-2-ylpropanamide
CID 174988669

Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide?
The IUPAC name of N,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide (CID 43675030) is N,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide.
What is the SMILES notation for N,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide?
The canonical SMILES for N,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide is CCCCCCCC(C)NC(CC(C)C)C(=O)N(C)C.
What is the InChIKey of N,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide?
The InChIKey is TVCBGQDHJPBAPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2O/c1-7-8-9-10-11-12-15(4)18-16(13-14(2)3)17(20)19(5)6/h14-16,18H,7-13H2,1-6H3.
What are the key properties of N,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide?
N,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide has a molecular weight of 284.49 g/mol, XLogP of 3.83, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethyl-2-(nonan-2-ylamino)pentanamide is sourced from PubChem (CID 43675030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).