3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide

C11H23N3O — CID 106274757

IUPAC3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide
SMILESCC(C)(CNC1CCCC(N)C1)C(N)=O
InChIInChI=1S/C11H23N3O/c1-11(2,10(13)15)7-14-9-5-3-4-8(12)6-9/h8-9,14H,3-7,12H2,1-2H3,(H2,13,15)
InChIKeyOZDGVPANFKEEGR-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.36
Rot. Bonds4

About 3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide

3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide (PubChem CID 106274757) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide.

Molecular Properties

Compound Name3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide
PubChem CID106274757
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide
SMILESCC(C)(CNC1CCCC(N)C1)C(N)=O
InChIInChI=1S/C11H23N3O/c1-11(2,10(13)15)7-14-9-5-3-4-8(12)6-9/h8-9,14H,3-7,12H2,1-2H3,(H2,13,15)
InChIKeyOZDGVPANFKEEGR-UHFFFAOYSA-N
XLogP0.36
TPSA81.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-3-[[3-(2-methylpropyl)cyclohexyl]amino]propanamide
CID 114078633
3-(cyclopentylamino)-2,2-dimethylpropanamide
CID 103617377
2,2-dimethyl-3-(oxan-3-ylamino)propanamide
CID 115978805
N-[2-[(3-aminocyclohexyl)amino]ethyl]acetamide
CID 79459016
3-[(4-methoxycyclohexyl)amino]-2,2-dimethylpropanamide
CID 104530552
2-[(3-aminocyclohexyl)amino]ethyl carbamate
CID 83202906
methyl 3-[(3-aminocyclohexyl)amino]propanoate
CID 79458540
1-[(3-aminocyclohexyl)amino]-4,4-dimethylpentan-2-ol
CID 107151355
1-N-propylcyclohexane-1,3-diamine
CID 22026573
2-[(3-aminocyclohexyl)amino]ethanol
CID 79459217
tert-butyl N-[(1R)-3-aminocyclohexyl]carbamate
CID 148734897
2-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-6-methylcyclohexane-1-carboxamide
CID 106280298

Frequently Asked Questions

What is the IUPAC name of 3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide?
The IUPAC name of 3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide (CID 106274757) is 3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide.
What is the SMILES notation for 3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide?
The canonical SMILES for 3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide is CC(C)(CNC1CCCC(N)C1)C(N)=O.
What is the InChIKey of 3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide?
The InChIKey is OZDGVPANFKEEGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-11(2,10(13)15)7-14-9-5-3-4-8(12)6-9/h8-9,14H,3-7,12H2,1-2H3,(H2,13,15).
What are the key properties of 3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide?
3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide has a molecular weight of 213.32 g/mol, XLogP of 0.36, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-aminocyclohexyl)amino]-2,2-dimethylpropanamide is sourced from PubChem (CID 106274757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).