N-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide

C14H30N2O — CID 60689682

IUPACN-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide
SMILESCC(C)CCC(C)NCC(=O)NC(C)C(C)C
InChIInChI=1S/C14H30N2O/c1-10(2)7-8-12(5)15-9-14(17)16-13(6)11(3)4/h10-13,15H,7-9H2,1-6H3,(H,16,17)
InChIKeyGVOPCZJIGCECOL-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.56
Rot. Bonds8

About N-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide

N-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide (PubChem CID 60689682) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is N-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide.

Molecular Properties

Compound NameN-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide
PubChem CID60689682
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC NameN-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide
SMILESCC(C)CCC(C)NCC(=O)NC(C)C(C)C
InChIInChI=1S/C14H30N2O/c1-10(2)7-8-12(5)15-9-14(17)16-13(6)11(3)4/h10-13,15H,7-9H2,1-6H3,(H,16,17)
InChIKeyGVOPCZJIGCECOL-UHFFFAOYSA-N
XLogP2.56
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-[[2-(3-methylbutan-2-ylamino)-2-oxoethyl]amino]propanoate
CID 60691411
N-(3-methylbutyl)-2-(5-methylhexan-2-ylamino)acetamide
CID 60672212
N-methyl-2-[[2-(3-methylbutan-2-ylamino)-2-oxoethyl]amino]propanamide
CID 61489451
2-[(1-hydroxy-4-methylpentan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 54961686
2-[[(2S)-5-methylhexan-2-yl]amino]-N-phenylacetamide
CID 95357768
N-(3-methylbutan-2-yl)-2-[1-(4-methylphenoxy)propan-2-ylamino]acetamide
CID 61489179
2-(pentan-2-ylamino)-N-propan-2-ylacetamide
CID 43179512
(2S)-5-methyl-N-[(2S)-3-methylbutan-2-yl]hexan-2-amine
CID 29036853
(2R)-5-methyl-N-[(2S)-3-methylbutan-2-yl]hexan-2-amine
CID 29036851
N-methyl-2-[[2-(3-methylbutan-2-ylamino)-2-oxoethyl]amino]acetamide
CID 60695644
2-hydroxy-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 172508602
N-(3-methylbutyl)-2-(pentan-2-ylamino)acetamide
CID 60672196

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide?
The IUPAC name of N-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide (CID 60689682) is N-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide.
What is the SMILES notation for N-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide?
The canonical SMILES for N-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide is CC(C)CCC(C)NCC(=O)NC(C)C(C)C.
What is the InChIKey of N-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide?
The InChIKey is GVOPCZJIGCECOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-10(2)7-8-12(5)15-9-14(17)16-13(6)11(3)4/h10-13,15H,7-9H2,1-6H3,(H,16,17).
What are the key properties of N-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide?
N-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide has a molecular weight of 242.41 g/mol, XLogP of 2.56, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutan-2-yl)-2-(5-methylhexan-2-ylamino)acetamide is sourced from PubChem (CID 60689682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).