N-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide

C14H24N2O — CID 114095959

IUPACN-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide
SMILESCCCNC(=O)C(C)NC1C2C3CCC(C3)C12
InChIInChI=1S/C14H24N2O/c1-3-6-15-14(17)8(2)16-13-11-9-4-5-10(7-9)12(11)13/h8-13,16H,3-7H2,1-2H3,(H,15,17)
InChIKeyDLLDDUNESOKQCM-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.54
Rot. Bonds5

About N-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide

N-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide (PubChem CID 114095959) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is N-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide.

Molecular Properties

Compound NameN-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide
PubChem CID114095959
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC NameN-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide
SMILESCCCNC(=O)C(C)NC1C2C3CCC(C3)C12
InChIInChI=1S/C14H24N2O/c1-3-6-15-14(17)8(2)16-13-11-9-4-5-10(7-9)12(11)13/h8-13,16H,3-7H2,1-2H3,(H,15,17)
InChIKeyDLLDDUNESOKQCM-UHFFFAOYSA-N
XLogP1.54
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-adamantylamino)-N-propylpropanamide
CID 43224055
1-propyl-3-(3-tricyclo[3.2.1.02,4]octanyl)urea
CID 103793569
2-(1-azabicyclo[3.2.1]octan-4-ylamino)-N-propylpropanamide
CID 105363972
2-(1-cyclopropylethylamino)-N-propylpropanamide
CID 43401278
N-[1-oxo-1-(propylamino)propan-2-yl]cyclopropanecarboxamide
CID 60659669
N-propyl-2-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)amino]propanamide
CID 60664094
2-[(2-tert-butylcyclohexyl)amino]-N-propylpropanamide
CID 43224075
(2S)-2-amino-3-methyl-N-(3-tricyclo[3.2.1.02,4]octanyl)pentanamide
CID 113315069
2-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-propylpropanamide
CID 106658282
2-(1-cyclopropylpropylamino)-N-propylpropanamide
CID 64917765
2-methyl-N-[1-oxo-1-(propylamino)propan-2-yl]propanamide
CID 60659584
(2S)-2-amino-N-(3-tricyclo[3.2.1.02,4]octanyl)hexanamide
CID 113304839

Frequently Asked Questions

What is the IUPAC name of N-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide?
The IUPAC name of N-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide (CID 114095959) is N-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide.
What is the SMILES notation for N-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide?
The canonical SMILES for N-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide is CCCNC(=O)C(C)NC1C2C3CCC(C3)C12.
What is the InChIKey of N-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide?
The InChIKey is DLLDDUNESOKQCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-3-6-15-14(17)8(2)16-13-11-9-4-5-10(7-9)12(11)13/h8-13,16H,3-7H2,1-2H3,(H,15,17).
What are the key properties of N-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide?
N-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide has a molecular weight of 236.36 g/mol, XLogP of 1.54, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-(3-tricyclo[3.2.1.02,4]octanylamino)propanamide is sourced from PubChem (CID 114095959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).