6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide

C16H35N3O — CID 65290403

IUPAC6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide
SMILESCC(C)CC(CN(C)C)NC(=O)CCC(C)(C)CCN
InChIInChI=1S/C16H35N3O/c1-13(2)11-14(12-19(5)6)18-15(20)7-8-16(3,4)9-10-17/h13-14H,7-12,17H2,1-6H3,(H,18,20)
InChIKeyKMNZHHQHFNEEQP-UHFFFAOYSA-N
MW285.48 g/mol
LogP2.23
Rot. Bonds10

About 6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide

6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide (PubChem CID 65290403) has the molecular formula C16H35N3O and a molecular weight of 285.48 g/mol. Its IUPAC name is 6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide.

Molecular Properties

Compound Name6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide
PubChem CID65290403
Molecular FormulaC16H35N3O
Molecular Weight285.48 g/mol
Exact Mass285.28
IUPAC Name6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide
SMILESCC(C)CC(CN(C)C)NC(=O)CCC(C)(C)CCN
InChIInChI=1S/C16H35N3O/c1-13(2)11-14(12-19(5)6)18-15(20)7-8-16(3,4)9-10-17/h13-14H,7-12,17H2,1-6H3,(H,18,20)
InChIKeyKMNZHHQHFNEEQP-UHFFFAOYSA-N
XLogP2.23
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.48
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-[1-(dimethylamino)-4-methylpentan-2-yl]propanamide
CID 43695730
(2S)-2-[(6-amino-4,4-dimethylhexanoyl)amino]-4-methylpentanoic acid
CID 79005179
tert-butyl 4-[[1-(dimethylamino)-4-methylpentan-2-yl]amino]-4-oxobutanoate
CID 106707208
6-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-4,4-dimethylhexanamide
CID 103109224
[1-(dimethylamino)-4-methylpentan-2-yl]urea
CID 61059405
6-amino-N-[(2S)-1-hydroxybutan-2-yl]-4,4-dimethylhexanamide
CID 107222403
6-amino-N-[(2R)-1-hydroxybutan-2-yl]-4,4-dimethylhexanamide
CID 107221314
(2R)-2-[(6-amino-4,4-dimethylhexanoyl)amino]propanoic acid
CID 65291208
methyl (2S)-2-[(6-amino-4,4-dimethylhexanoyl)amino]propanoate
CID 65290947
6-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-4,4-dimethylhexanamide
CID 79250281
N-(1-amino-4-methylpentan-2-yl)-4,4,4-trifluorobutanamide;hydrochloride
CID 119588676
6-amino-4,4-dimethyl-N-(7-methyloctyl)hexanamide
CID 65292309

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide?
The IUPAC name of 6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide (CID 65290403) is 6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide.
What is the SMILES notation for 6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide?
The canonical SMILES for 6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide is CC(C)CC(CN(C)C)NC(=O)CCC(C)(C)CCN.
What is the InChIKey of 6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide?
The InChIKey is KMNZHHQHFNEEQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35N3O/c1-13(2)11-14(12-19(5)6)18-15(20)7-8-16(3,4)9-10-17/h13-14H,7-12,17H2,1-6H3,(H,18,20).
What are the key properties of 6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide?
6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide has a molecular weight of 285.48 g/mol, XLogP of 2.23, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-4,4-dimethylhexanamide is sourced from PubChem (CID 65290403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).