1-amino-N-propylcyclohexane-1-carboxamide

C10H20N2O — CID 24701829

IUPAC1-amino-N-propylcyclohexane-1-carboxamide
SMILESCCCNC(=O)C1(N)CCCCC1
InChIInChI=1S/C10H20N2O/c1-2-8-12-9(13)10(11)6-4-3-5-7-10/h2-8,11H2,1H3,(H,12,13)
InChIKeyQTPSTJFEZGTHLF-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.17
Rot. Bonds3

About 1-amino-N-propylcyclohexane-1-carboxamide

1-amino-N-propylcyclohexane-1-carboxamide (PubChem CID 24701829) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-amino-N-propylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-propylcyclohexane-1-carboxamide
PubChem CID24701829
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1-amino-N-propylcyclohexane-1-carboxamide
SMILESCCCNC(=O)C1(N)CCCCC1
InChIInChI=1S/C10H20N2O/c1-2-8-12-9(13)10(11)6-4-3-5-7-10/h2-8,11H2,1H3,(H,12,13)
InChIKeyQTPSTJFEZGTHLF-UHFFFAOYSA-N
XLogP1.17
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-propylcyclohexane-1-carboxamide?
The IUPAC name of 1-amino-N-propylcyclohexane-1-carboxamide (CID 24701829) is 1-amino-N-propylcyclohexane-1-carboxamide.
What is the SMILES notation for 1-amino-N-propylcyclohexane-1-carboxamide?
The canonical SMILES for 1-amino-N-propylcyclohexane-1-carboxamide is CCCNC(=O)C1(N)CCCCC1.
What is the InChIKey of 1-amino-N-propylcyclohexane-1-carboxamide?
The InChIKey is QTPSTJFEZGTHLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-2-8-12-9(13)10(11)6-4-3-5-7-10/h2-8,11H2,1H3,(H,12,13).
What are the key properties of 1-amino-N-propylcyclohexane-1-carboxamide?
1-amino-N-propylcyclohexane-1-carboxamide has a molecular weight of 184.28 g/mol, XLogP of 1.17, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-propylcyclohexane-1-carboxamide is sourced from PubChem (CID 24701829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).