1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide

C14H23F3N2O — CID 115434980

IUPAC1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide
SMILESCC(C1CC1)N(CC(F)(F)F)C(=O)C1(CN)CCCC1
InChIInChI=1S/C14H23F3N2O/c1-10(11-4-5-11)19(9-14(15,16)17)12(20)13(8-18)6-2-3-7-13/h10-11H,2-9,18H2,1H3
InChIKeyNYSLZAQSFYJNSE-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.69
Rot. Bonds5

About 1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide

1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide (PubChem CID 115434980) has the molecular formula C14H23F3N2O and a molecular weight of 292.34 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide
PubChem CID115434980
Molecular FormulaC14H23F3N2O
Molecular Weight292.34 g/mol
Exact Mass292.18
IUPAC Name1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide
SMILESCC(C1CC1)N(CC(F)(F)F)C(=O)C1(CN)CCCC1
InChIInChI=1S/C14H23F3N2O/c1-10(11-4-5-11)19(9-14(15,16)17)12(20)13(8-18)6-2-3-7-13/h10-11H,2-9,18H2,1H3
InChIKeyNYSLZAQSFYJNSE-UHFFFAOYSA-N
XLogP2.69
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-(1-cyclopropylethyl)-3-methyl-N-(2,2,2-trifluoroethyl)cyclohexane-1-carboxamide
CID 64549410
N-(1-cyclopropylethyl)-2-ethyl-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide
CID 83071498
N-(1-cyclopropylethyl)-2-methyl-N-(2,2,2-trifluoroethyl)propanamide
CID 60717510
2-(2-aminoethoxy)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)acetamide
CID 79473073
N-(1-cyclopropylethyl)-2-propyl-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide
CID 106974581
6-amino-N-(1-cyclopropylethyl)-4,4-dimethyl-N-(2,2,2-trifluoroethyl)hexanamide
CID 65290581
2-amino-N-(1-cyclopropylethyl)-2-ethyl-N-(2,2,2-trifluoroethyl)butanamide
CID 79809276
2-amino-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide
CID 55036006
1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-4-methylcyclohexane-1-carboxamide
CID 115441735
3-chloro-N-(1-cyclopropylethyl)-2-methyl-N-(2,2,2-trifluoroethyl)propanamide
CID 55110482
3-chloro-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)propanamide
CID 60948883
1-(aminomethyl)-N-(1-cyclopropylethyl)-N,4-dimethylcyclohexane-1-carboxamide
CID 115441526

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide (CID 115434980) is 1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide is CC(C1CC1)N(CC(F)(F)F)C(=O)C1(CN)CCCC1.
What is the InChIKey of 1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide?
The InChIKey is NYSLZAQSFYJNSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23F3N2O/c1-10(11-4-5-11)19(9-14(15,16)17)12(20)13(8-18)6-2-3-7-13/h10-11H,2-9,18H2,1H3.
What are the key properties of 1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide?
1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 2.69, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 115434980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).