1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide

C19H29N3O2 — CID 119853255

IUPAC1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide
SMILESNC1(C(=O)NCC(c2ccccc2)N2CCOCC2)CCCCC1
InChIInChI=1S/C19H29N3O2/c20-19(9-5-2-6-10-19)18(23)21-15-17(16-7-3-1-4-8-16)22-11-13-24-14-12-22/h1,3-4,7-8,17H,2,5-6,9-15,20H2,(H,21,23)
InChIKeyTVVQVUAKRSSYJC-UHFFFAOYSA-N
MW331.46 g/mol
LogP1.84
Rot. Bonds5

About 1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide

1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide (PubChem CID 119853255) has the molecular formula C19H29N3O2 and a molecular weight of 331.46 g/mol. Its IUPAC name is 1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide
PubChem CID119853255
Molecular FormulaC19H29N3O2
Molecular Weight331.46 g/mol
Exact Mass331.23
IUPAC Name1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide
SMILESNC1(C(=O)NCC(c2ccccc2)N2CCOCC2)CCCCC1
InChIInChI=1S/C19H29N3O2/c20-19(9-5-2-6-10-19)18(23)21-15-17(16-7-3-1-4-8-16)22-11-13-24-14-12-22/h1,3-4,7-8,17H,2,5-6,9-15,20H2,(H,21,23)
InChIKeyTVVQVUAKRSSYJC-UHFFFAOYSA-N
XLogP1.84
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.46
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119859906
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CID 65465775
4-(aminomethyl)-N-(2-morpholin-4-yl-2-phenylethyl)oxane-4-carboxamide;dihydrochloride
CID 120939367
1-amino-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]cyclohexane-1-carboxamide;dihydrochloride
CID 119837797
1-amino-N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]cyclopropane-1-carboxamide;dihydrochloride
CID 119865951
1-amino-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)cyclopropane-1-carboxamide
CID 65464082
N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-1-phenylcyclobutane-1-carboxamide
CID 60596926
1-amino-N-(2-hydroxy-2-phenylethyl)cyclohexane-1-carboxamide
CID 43500059
N-(2-morpholin-4-yl-2-phenylethyl)cyclobutanecarboxamide
CID 42948395
N-(2-morpholin-4-yl-2-phenylethyl)cyclopentanecarboxamide
CID 42948396
N-[2-(azepan-1-yl)-2-phenylethyl]-2-morpholin-4-ylacetamide
CID 118792707
1-amino-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]cyclopentane-1-carboxamide
CID 61250554

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide?
The IUPAC name of 1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide (CID 119853255) is 1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide is NC1(C(=O)NCC(c2ccccc2)N2CCOCC2)CCCCC1.
What is the InChIKey of 1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide?
The InChIKey is TVVQVUAKRSSYJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O2/c20-19(9-5-2-6-10-19)18(23)21-15-17(16-7-3-1-4-8-16)22-11-13-24-14-12-22/h1,3-4,7-8,17H,2,5-6,9-15,20H2,(H,21,23).
What are the key properties of 1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide?
1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide has a molecular weight of 331.46 g/mol, XLogP of 1.84, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(2-morpholin-4-yl-2-phenylethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 119853255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).