N-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide

C16H30N2O — CID 66469565

IUPACN-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide
SMILESCCCN(C(=O)C1CCC2CCCCC2N1)C(C)C
InChIInChI=1S/C16H30N2O/c1-4-11-18(12(2)3)16(19)15-10-9-13-7-5-6-8-14(13)17-15/h12-15,17H,4-11H2,1-3H3
InChIKeySNHFCWOUAWEDQR-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.94
Rot. Bonds4

About N-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide

N-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide (PubChem CID 66469565) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide.

Molecular Properties

Compound NameN-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide
PubChem CID66469565
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide
SMILESCCCN(C(=O)C1CCC2CCCCC2N1)C(C)C
InChIInChI=1S/C16H30N2O/c1-4-11-18(12(2)3)16(19)15-10-9-13-7-5-6-8-14(13)17-15/h12-15,17H,4-11H2,1-3H3
InChIKeySNHFCWOUAWEDQR-UHFFFAOYSA-N
XLogP2.94
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide?
The IUPAC name of N-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide (CID 66469565) is N-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide.
What is the SMILES notation for N-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide?
The canonical SMILES for N-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide is CCCN(C(=O)C1CCC2CCCCC2N1)C(C)C.
What is the InChIKey of N-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide?
The InChIKey is SNHFCWOUAWEDQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-4-11-18(12(2)3)16(19)15-10-9-13-7-5-6-8-14(13)17-15/h12-15,17H,4-11H2,1-3H3.
What are the key properties of N-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide?
N-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide has a molecular weight of 266.43 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-N-propyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline-2-carboxamide is sourced from PubChem (CID 66469565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).