7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide

C11H24N2O2 — CID 43500036

IUPAC7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide
SMILESCC(C)(CO)NC(=O)CCCCCCN
InChIInChI=1S/C11H24N2O2/c1-11(2,9-14)13-10(15)7-5-3-4-6-8-12/h14H,3-9,12H2,1-2H3,(H,13,15)
InChIKeyLANVQKKRSXURKY-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.78
Rot. Bonds8

About 7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide

7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide (PubChem CID 43500036) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide.

Molecular Properties

Compound Name7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide
PubChem CID43500036
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide
SMILESCC(C)(CO)NC(=O)CCCCCCN
InChIInChI=1S/C11H24N2O2/c1-11(2,9-14)13-10(15)7-5-3-4-6-8-12/h14H,3-9,12H2,1-2H3,(H,13,15)
InChIKeyLANVQKKRSXURKY-UHFFFAOYSA-N
XLogP0.78
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(1-hydroxy-2-methylpropan-2-yl)dodecanamide
CID 13410459
6-amino-N-[2-methyl-4-(2,3,3-trimethylbutan-2-yloxy)butan-2-yl]hexanamide
CID 167239667
N-(1-hydroxy-2-methylpropan-2-yl)-5-oxoheptanamide
CID 171807744
4-(6-aminohexanoylamino)-4-methylheptanedioic acid
CID 146234237
5-amino-N-(3-hydroxy-2,2-dimethylpropyl)pentanamide
CID 115360270
3-chloro-N-(1-hydroxy-2-methylpropan-2-yl)propanamide
CID 61251175
2-(7-aminoheptanoylamino)-2-methylpentanoic acid
CID 61161031
6-amino-N-(2-hydroxy-2-methylpropyl)hexanamide
CID 65106883
4-amino-N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]butanamide
CID 107865748
4-(6-aminohexanoylamino)-4-(2-carboxyethyl)heptanedioic acid
CID 146233912
14-amino-N-hydroxytetradecanamide
CID 87686192
20-amino-N-hydroxyicosanamide
CID 87686702

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide?
The IUPAC name of 7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide (CID 43500036) is 7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide.
What is the SMILES notation for 7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide?
The canonical SMILES for 7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide is CC(C)(CO)NC(=O)CCCCCCN.
What is the InChIKey of 7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide?
The InChIKey is LANVQKKRSXURKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-11(2,9-14)13-10(15)7-5-3-4-6-8-12/h14H,3-9,12H2,1-2H3,(H,13,15).
What are the key properties of 7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide?
7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide has a molecular weight of 216.32 g/mol, XLogP of 0.78, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-(1-hydroxy-2-methylpropan-2-yl)heptanamide is sourced from PubChem (CID 43500036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).