1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide

C11H22N2O — CID 81179596

IUPAC1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide
SMILESCCCN(C(=O)C1(N)CCC1)C(C)C
InChIInChI=1S/C11H22N2O/c1-4-8-13(9(2)3)10(14)11(12)6-5-7-11/h9H,4-8,12H2,1-3H3
InChIKeyAULYZKRDNIWMTN-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.51
Rot. Bonds4

About 1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide

1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide (PubChem CID 81179596) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide
PubChem CID81179596
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide
SMILESCCCN(C(=O)C1(N)CCC1)C(C)C
InChIInChI=1S/C11H22N2O/c1-4-8-13(9(2)3)10(14)11(12)6-5-7-11/h9H,4-8,12H2,1-3H3
InChIKeyAULYZKRDNIWMTN-UHFFFAOYSA-N
XLogP1.51
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-propan-2-yl-N-propylcyclopropane-1-carboxamide
CID 65466563
3-amino-N-propan-2-yl-N-propyloxolane-3-carboxamide
CID 64892499
3-[(1-aminocyclohexanecarbonyl)-propan-2-ylamino]propanoic acid
CID 61161466
1-amino-N,N-dipropylcyclobutane-1-carboxamide
CID 81167159
1-amino-N-butan-2-yl-N-ethylcyclobutane-1-carboxamide
CID 81178764
2-(1-aminocyclobutyl)-N-propan-2-yl-N-propylacetamide
CID 79851810
1-amino-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclohexane-1-carboxamide
CID 60947116
1-cyano-N-propan-2-yl-N-propylcyclopentane-1-carboxamide
CID 55135248
1-amino-N-(cyclopropylmethyl)-N-propan-2-ylcyclohexane-1-carboxamide
CID 55000242
1-amino-N-[2-(dimethylamino)ethyl]-N-propylcyclobutane-1-carboxamide
CID 81169609
1-amino-N-(2-hydroxyethyl)-3-methyl-N-propan-2-ylcyclohexane-1-carboxamide
CID 64550859
N-propan-2-yl-N,2-dipropylpyrrolidine-2-carboxamide
CID 106974202

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide?
The IUPAC name of 1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide (CID 81179596) is 1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide.
What is the SMILES notation for 1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide?
The canonical SMILES for 1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide is CCCN(C(=O)C1(N)CCC1)C(C)C.
What is the InChIKey of 1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide?
The InChIKey is AULYZKRDNIWMTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-4-8-13(9(2)3)10(14)11(12)6-5-7-11/h9H,4-8,12H2,1-3H3.
What are the key properties of 1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide?
1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide has a molecular weight of 198.31 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-propan-2-yl-N-propylcyclobutane-1-carboxamide is sourced from PubChem (CID 81179596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).