N-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide

C14H23F3N2O2 — CID 129003823

IUPACN-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide
SMILESCN1CCOC(CN(CC2CC2)C(=O)CCC(F)(F)F)C1
InChIInChI=1S/C14H23F3N2O2/c1-18-6-7-21-12(9-18)10-19(8-11-2-3-11)13(20)4-5-14(15,16)17/h11-12H,2-10H2,1H3
InChIKeyJMMAMWSTOXQFQF-UHFFFAOYSA-N
MW308.34 g/mol
LogP1.90
Rot. Bonds6

About N-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide

N-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide (PubChem CID 129003823) has the molecular formula C14H23F3N2O2 and a molecular weight of 308.34 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide
PubChem CID129003823
Molecular FormulaC14H23F3N2O2
Molecular Weight308.34 g/mol
Exact Mass308.17
IUPAC NameN-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide
SMILESCN1CCOC(CN(CC2CC2)C(=O)CCC(F)(F)F)C1
InChIInChI=1S/C14H23F3N2O2/c1-18-6-7-21-12(9-18)10-19(8-11-2-3-11)13(20)4-5-14(15,16)17/h11-12H,2-10H2,1H3
InChIKeyJMMAMWSTOXQFQF-UHFFFAOYSA-N
XLogP1.90
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-cyclobutyl-N-(cyclopropylmethyl)-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide
CID 129331809
N-(cyclopropylmethyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]-3-[(3S)-oxolan-3-yl]propanamide
CID 129330348
2-acetamido-N-(cyclopropylmethyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]acetamide
CID 129342815
N-(cyclopropylmethyl)-2-(methanesulfonamido)-N-[(4-methylmorpholin-2-yl)methyl]acetamide
CID 129002104
3-[cyclopropylmethyl-[(4-methylmorpholin-2-yl)methyl]carbamoyl]-4-methylbenzoic acid
CID 146141590
N-(cyclopropylmethyl)-4-fluoro-2-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]benzamide
CID 129478586
N-(cyclopropylmethyl)-2-fluoro-5-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]benzamide
CID 129478726
(2R)-N-(cyclopropylmethyl)-2-hydroxy-N-[(4-methylmorpholin-2-yl)methyl]-2-phenylacetamide
CID 128970007
N-(cyclopropylmethyl)-5-fluoro-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pyridine-2-carboxamide
CID 129478828
N-(cyclopropylmethyl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]-1H-pyrazole-4-carboxamide
CID 129478448
1-(cyclopropylmethyl)-1-[[(2R)-4-methylmorpholin-2-yl]methyl]-3-(2-pyrrol-1-ylethyl)urea
CID 129476167
N-(cyclopropylmethyl)-3-ethyl-1-methyl-N-[[(2R)-4-methylmorpholin-2-yl]methyl]pyrazole-4-carboxamide
CID 129331504

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide?
The IUPAC name of N-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide (CID 129003823) is N-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide.
What is the SMILES notation for N-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide?
The canonical SMILES for N-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide is CN1CCOC(CN(CC2CC2)C(=O)CCC(F)(F)F)C1.
What is the InChIKey of N-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide?
The InChIKey is JMMAMWSTOXQFQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23F3N2O2/c1-18-6-7-21-12(9-18)10-19(8-11-2-3-11)13(20)4-5-14(15,16)17/h11-12H,2-10H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide?
N-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide has a molecular weight of 308.34 g/mol, XLogP of 1.90, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-4,4,4-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]butanamide is sourced from PubChem (CID 129003823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).