2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide

C17H24N2O2 — CID 38290092

IUPAC2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide
SMILESCC1(C)CN(C(=O)NCC2(c3ccccc3)CC2)CCO1
InChIInChI=1S/C17H24N2O2/c1-16(2)13-19(10-11-21-16)15(20)18-12-17(8-9-17)14-6-4-3-5-7-14/h3-7H,8-13H2,1-2H3,(H,18,20)
InChIKeyDRLHJABCRKYNKQ-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.54
Rot. Bonds3

About 2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide

2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide (PubChem CID 38290092) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide
PubChem CID38290092
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide
SMILESCC1(C)CN(C(=O)NCC2(c3ccccc3)CC2)CCO1
InChIInChI=1S/C17H24N2O2/c1-16(2)13-19(10-11-21-16)15(20)18-12-17(8-9-17)14-6-4-3-5-7-14/h3-7H,8-13H2,1-2H3,(H,18,20)
InChIKeyDRLHJABCRKYNKQ-UHFFFAOYSA-N
XLogP2.54
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-2,2-dimethylmorpholine-4-carboxamide
CID 38286944
N-ethyl-2,2-dimethylmorpholine-4-carboxamide
CID 115583911
4-[[(2,2-dimethylmorpholine-4-carbonyl)amino]methyl]benzoic acid
CID 61202032
(2,2-dimethylmorpholin-4-yl)-(1-phenylcyclobutyl)methanone
CID 86983017
2-[(2,2-dimethylmorpholine-4-carbonyl)amino]benzoic acid
CID 61202030
4-(1-hydroxyethyl)-N-[(1-phenylcyclopropyl)methyl]piperidine-1-carboxamide
CID 111438064
(2R)-2-[(2,2-dimethylmorpholine-4-carbonyl)amino]-2-phenylacetic acid
CID 61202574
4-[(2,2-dimethylmorpholine-4-carbonyl)amino]-2-hydroxybutanoic acid
CID 107838552
N-[[1-(4-chlorophenyl)cyclopropyl]methyl]morpholine-4-carboxamide
CID 113214436
3-(hydroxymethyl)-N-[(4-phenyloxan-4-yl)methyl]pyrrolidine-1-carboxamide
CID 111443730
3-oxo-N-[(1-phenylcyclopropyl)methyl]butanamide
CID 110470652
N-[(1-phenylcyclopropyl)methyl]-4-pyridin-4-ylpiperazine-1-carboxamide
CID 30303440

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide?
The IUPAC name of 2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide (CID 38290092) is 2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide.
What is the SMILES notation for 2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide?
The canonical SMILES for 2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide is CC1(C)CN(C(=O)NCC2(c3ccccc3)CC2)CCO1.
What is the InChIKey of 2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide?
The InChIKey is DRLHJABCRKYNKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-16(2)13-19(10-11-21-16)15(20)18-12-17(8-9-17)14-6-4-3-5-7-14/h3-7H,8-13H2,1-2H3,(H,18,20).
What are the key properties of 2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide?
2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[(1-phenylcyclopropyl)methyl]morpholine-4-carboxamide is sourced from PubChem (CID 38290092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).