N-propyl-3-[(4-propylcycloheptyl)amino]propanamide

C16H32N2O — CID 65091128

IUPACN-propyl-3-[(4-propylcycloheptyl)amino]propanamide
SMILESCCCNC(=O)CCNC1CCCC(CCC)CC1
InChIInChI=1S/C16H32N2O/c1-3-6-14-7-5-8-15(10-9-14)17-13-11-16(19)18-12-4-2/h14-15,17H,3-13H2,1-2H3,(H,18,19)
InChIKeyOCLLOHSRSNTTBY-UHFFFAOYSA-N
MW268.44 g/mol
LogP3.24
Rot. Bonds8

About N-propyl-3-[(4-propylcycloheptyl)amino]propanamide

N-propyl-3-[(4-propylcycloheptyl)amino]propanamide (PubChem CID 65091128) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N-propyl-3-[(4-propylcycloheptyl)amino]propanamide.

Molecular Properties

Compound NameN-propyl-3-[(4-propylcycloheptyl)amino]propanamide
PubChem CID65091128
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN-propyl-3-[(4-propylcycloheptyl)amino]propanamide
SMILESCCCNC(=O)CCNC1CCCC(CCC)CC1
InChIInChI=1S/C16H32N2O/c1-3-6-14-7-5-8-15(10-9-14)17-13-11-16(19)18-12-4-2/h14-15,17H,3-13H2,1-2H3,(H,18,19)
InChIKeyOCLLOHSRSNTTBY-UHFFFAOYSA-N
XLogP3.24
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(4-propylcycloheptyl)amino]propanamide
CID 65086939
3-[(4-propan-2-ylcycloheptyl)amino]-N-propylpropanamide
CID 65091127
3-[(4-tert-butylcyclohexyl)amino]-N-propylpropanamide
CID 61060237
methyl 4-[(4-propylcycloheptyl)amino]butanoate
CID 65091252
N-butyl-3-(cyclopentylamino)propanamide
CID 109012177
3-[(3-cyclopropylcyclohexyl)amino]-N-propylpropanamide
CID 64623786
N-methyl-2-[(4-propylcycloheptyl)amino]acetamide
CID 65086398
N-propyl-3-(thian-4-ylamino)propanamide
CID 61060687
1-(2-cyclobutylethyl)-3-propylurea
CID 115686559
2-[(4-propylcyclohexyl)amino]ethylurea
CID 83111793
3-cyclopentyl-N-[2-(propylamino)ethyl]propanamide
CID 62658625
N-ethyl-3-[(3-ethylcyclohexyl)amino]propanamide
CID 64743974

Frequently Asked Questions

What is the IUPAC name of N-propyl-3-[(4-propylcycloheptyl)amino]propanamide?
The IUPAC name of N-propyl-3-[(4-propylcycloheptyl)amino]propanamide (CID 65091128) is N-propyl-3-[(4-propylcycloheptyl)amino]propanamide.
What is the SMILES notation for N-propyl-3-[(4-propylcycloheptyl)amino]propanamide?
The canonical SMILES for N-propyl-3-[(4-propylcycloheptyl)amino]propanamide is CCCNC(=O)CCNC1CCCC(CCC)CC1.
What is the InChIKey of N-propyl-3-[(4-propylcycloheptyl)amino]propanamide?
The InChIKey is OCLLOHSRSNTTBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-3-6-14-7-5-8-15(10-9-14)17-13-11-16(19)18-12-4-2/h14-15,17H,3-13H2,1-2H3,(H,18,19).
What are the key properties of N-propyl-3-[(4-propylcycloheptyl)amino]propanamide?
N-propyl-3-[(4-propylcycloheptyl)amino]propanamide has a molecular weight of 268.44 g/mol, XLogP of 3.24, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-3-[(4-propylcycloheptyl)amino]propanamide is sourced from PubChem (CID 65091128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).