N-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide

C16H30N2O — CID 66476059

IUPACN-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)N(CCCN)C2CCCC2)C1(C)C
InChIInChI=1S/C16H30N2O/c1-15(2)13(16(15,3)4)14(19)18(11-7-10-17)12-8-5-6-9-12/h12-13H,5-11,17H2,1-4H3
InChIKeyLBAVONAHRBPUCH-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.79
Rot. Bonds5

About N-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide

N-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide (PubChem CID 66476059) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide
PubChem CID66476059
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)N(CCCN)C2CCCC2)C1(C)C
InChIInChI=1S/C16H30N2O/c1-15(2)13(16(15,3)4)14(19)18(11-7-10-17)12-8-5-6-9-12/h12-13H,5-11,17H2,1-4H3
InChIKeyLBAVONAHRBPUCH-UHFFFAOYSA-N
XLogP2.79
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-aminopropyl)-N-cyclohexylcycloheptanecarboxamide
CID 62586831
1-(3-aminopropyl)-1-cycloheptyl-3,3-dimethylurea
CID 79153945
N-(3-aminopropyl)-N-cyclobutyl-4,4-difluorocyclohexane-1-carboxamide
CID 102873906
N-(3-aminopropyl)-N-cyclohexyl-2,2-dimethylpropanamide
CID 43136880
methyl 2-[cyclopentyl-(2,2,3,3-tetramethylcyclopropanecarbonyl)amino]acetate
CID 80709783
3-amino-N-(3-aminopropyl)-N-cyclohexylpropanamide
CID 134484716
N-(3-aminopropyl)-N-cycloheptylbutanamide
CID 43136885
N-(3-aminopropyl)-N-cyclobutyloxane-4-carboxamide
CID 102873819
3-aminopropyl-[(4Z)-cyclooct-4-en-1-yl]carbamic acid;hydrochloride
CID 176888816
N-(3-aminopropyl)-N-cyclohexyloxolane-2-carboxamide
CID 43136866
N-(3-aminopropyl)-N-cycloheptyl-3,3-dimethylbutanamide
CID 43319428
N-(3-aminopropyl)-N-cyclobutyl-2-(trifluoromethyl)cyclohexane-1-carboxamide
CID 102873908

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The IUPAC name of N-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide (CID 66476059) is N-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The canonical SMILES for N-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide is CC1(C)C(C(=O)N(CCCN)C2CCCC2)C1(C)C.
What is the InChIKey of N-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The InChIKey is LBAVONAHRBPUCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-15(2)13(16(15,3)4)14(19)18(11-7-10-17)12-8-5-6-9-12/h12-13H,5-11,17H2,1-4H3.
What are the key properties of N-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
N-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide has a molecular weight of 266.43 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-cyclopentyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide is sourced from PubChem (CID 66476059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).