3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide

C11H24N2O2 — CID 81484725

IUPAC3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide
SMILESCC(C)OCCCNC(=O)C(C)(C)CN
InChIInChI=1S/C11H24N2O2/c1-9(2)15-7-5-6-13-10(14)11(3,4)8-12/h9H,5-8,12H2,1-4H3,(H,13,14)
InChIKeyZRRXMCPMKCACQY-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.90
Rot. Bonds7

About 3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide

3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide (PubChem CID 81484725) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide.

Molecular Properties

Compound Name3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide
PubChem CID81484725
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide
SMILESCC(C)OCCCNC(=O)C(C)(C)CN
InChIInChI=1S/C11H24N2O2/c1-9(2)15-7-5-6-13-10(14)11(3,4)8-12/h9H,5-8,12H2,1-4H3,(H,13,14)
InChIKeyZRRXMCPMKCACQY-UHFFFAOYSA-N
XLogP0.90
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(aminomethyl)-2-methyl-N-(2-propan-2-yloxyethyl)butanamide
CID 104759857
2-(aminomethyl)-2-ethyl-N-(2-propan-2-yloxyethyl)butanamide
CID 104759851
(2R)-2-amino-3-methyl-N-(3-propan-2-yloxypropyl)butanamide
CID 79012909
4-amino-2-methyl-N-(3-propan-2-yloxypropyl)butanamide
CID 80543906
4-amino-3-methoxy-N-(3-propan-2-yloxypropyl)butanamide
CID 103155532
4-amino-3-methyl-N-(3-propan-2-yloxypropyl)butanamide
CID 81086754
(2S)-2-chloro-N-(3-propan-2-yloxypropyl)propanamide
CID 92660589
2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-(3-propan-2-yloxypropyl)acetamide
CID 79661979
5,5-dimethyl-N-(3-propan-2-yloxypropyl)hexanamide
CID 156551412
7-amino-N-(3-propan-2-yloxypropyl)heptanamide
CID 61275030
2,2,2-trifluoroethyl N-(3-propan-2-yloxypropyl)carbamate
CID 60705940
methyl 3-[(3-amino-2,2-dimethylpropanoyl)amino]propanoate
CID 81489476

Frequently Asked Questions

What is the IUPAC name of 3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide?
The IUPAC name of 3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide (CID 81484725) is 3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide.
What is the SMILES notation for 3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide?
The canonical SMILES for 3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide is CC(C)OCCCNC(=O)C(C)(C)CN.
What is the InChIKey of 3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide?
The InChIKey is ZRRXMCPMKCACQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-9(2)15-7-5-6-13-10(14)11(3,4)8-12/h9H,5-8,12H2,1-4H3,(H,13,14).
What are the key properties of 3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide?
3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide has a molecular weight of 216.32 g/mol, XLogP of 0.90, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2,2-dimethyl-N-(3-propan-2-yloxypropyl)propanamide is sourced from PubChem (CID 81484725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).