2-amino-N-heptan-2-yl-2-methylpropanamide

C11H24N2O — CID 61264408

IUPAC2-amino-N-heptan-2-yl-2-methylpropanamide
SMILESCCCCCC(C)NC(=O)C(C)(C)N
InChIInChI=1S/C11H24N2O/c1-5-6-7-8-9(2)13-10(14)11(3,4)12/h9H,5-8,12H2,1-4H3,(H,13,14)
InChIKeyUFWSNFDSMZXOGQ-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.81
Rot. Bonds6

About 2-amino-N-heptan-2-yl-2-methylpropanamide

2-amino-N-heptan-2-yl-2-methylpropanamide (PubChem CID 61264408) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 2-amino-N-heptan-2-yl-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-heptan-2-yl-2-methylpropanamide
PubChem CID61264408
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name2-amino-N-heptan-2-yl-2-methylpropanamide
SMILESCCCCCC(C)NC(=O)C(C)(C)N
InChIInChI=1S/C11H24N2O/c1-5-6-7-8-9(2)13-10(14)11(3,4)12/h9H,5-8,12H2,1-4H3,(H,13,14)
InChIKeyUFWSNFDSMZXOGQ-UHFFFAOYSA-N
XLogP1.81
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.81
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

2-amino-2-cyclopropyl-N-hexan-2-ylpropanamide
CID 62198947
3-amino-3-methyl-N-octan-2-ylbutanamide
CID 64684049
2-carbamothioyl-N-heptan-2-yl-2-methylbutanamide
CID 113270547
(2S)-2-amino-N-heptan-2-yl-3,3-dimethylbutanamide
CID 61154567
2,2,3,3,4,4,5,5,6,6-decafluoro-N,N'-di(heptan-2-yl)heptanediamide
CID 3633560
2,2,3,3-tetrafluoro-N-octan-2-ylpropanamide
CID 103732426
2-(N'-hydroxycarbamimidoyl)-2-methyl-N-octan-2-ylbutanamide
CID 114292771
(2R)-2-amino-N-heptan-2-ylpropanamide
CID 78972371
tert-butyl N-[(2R)-heptan-2-yl]carbamate
CID 25171533
3-amino-N-hexan-2-yl-3-methylbutanamide
CID 64677229
N-dodecan-2-ylpropanamide
CID 174988669
2-amino-N-hexan-2-yl-2-phenylpropanamide
CID 62489354

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-heptan-2-yl-2-methylpropanamide?
The IUPAC name of 2-amino-N-heptan-2-yl-2-methylpropanamide (CID 61264408) is 2-amino-N-heptan-2-yl-2-methylpropanamide.
What is the SMILES notation for 2-amino-N-heptan-2-yl-2-methylpropanamide?
The canonical SMILES for 2-amino-N-heptan-2-yl-2-methylpropanamide is CCCCCC(C)NC(=O)C(C)(C)N.
What is the InChIKey of 2-amino-N-heptan-2-yl-2-methylpropanamide?
The InChIKey is UFWSNFDSMZXOGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-5-6-7-8-9(2)13-10(14)11(3,4)12/h9H,5-8,12H2,1-4H3,(H,13,14).
What are the key properties of 2-amino-N-heptan-2-yl-2-methylpropanamide?
2-amino-N-heptan-2-yl-2-methylpropanamide has a molecular weight of 200.33 g/mol, XLogP of 1.81, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-heptan-2-yl-2-methylpropanamide is sourced from PubChem (CID 61264408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).