N-cycloheptylmorpholine-4-carboxamide

C12H22N2O2 — CID 669639

IUPACN-cycloheptylmorpholine-4-carboxamide
SMILESO=C(NC1CCCCCC1)N1CCOCC1
InChIInChI=1S/C12H22N2O2/c15-12(14-7-9-16-10-8-14)13-11-5-3-1-2-4-6-11/h11H,1-10H2,(H,13,15)
InChIKeyKUAQTBLFXCDWPF-UHFFFAOYSA-N
MW226.32 g/mol
LogP1.75
Rot. Bonds1

About N-cycloheptylmorpholine-4-carboxamide

N-cycloheptylmorpholine-4-carboxamide (PubChem CID 669639) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-cycloheptylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-cycloheptylmorpholine-4-carboxamide
PubChem CID669639
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-cycloheptylmorpholine-4-carboxamide
SMILESO=C(NC1CCCCCC1)N1CCOCC1
InChIInChI=1S/C12H22N2O2/c15-12(14-7-9-16-10-8-14)13-11-5-3-1-2-4-6-11/h11H,1-10H2,(H,13,15)
InChIKeyKUAQTBLFXCDWPF-UHFFFAOYSA-N
XLogP1.75
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-N'-[3-(4-morpholinyl)propyl]urea
CID 1987766
4-(N-(Cyclohexyl)carbamoyl)morpholine
CID 853662
4-Morpholinecarboxamide, N-dodecyl-
CID 3064262
3-Cyclohexyl-1,1-bis(2-methoxyethyl)urea
CID 75401832
N-(2-methoxyethyl)-4-(propan-2-ylamino)piperidine-1-carboxamide
CID 72018405
N-(pentan-2-yl)morpholine-4-carboxamide
CID 3137306
N-(pentan-3-yl)morpholine-4-carboxamide
CID 787327
1-Cyclohexyl-3-(4-morpholinobut-2-yn-1-yl)urea
CID 71792717
N-(2-methylpropyl)-2-(morpholin-4-ylmethyl)azepane-1-carboxamide
CID 110196375
N-ethyl-2-(morpholin-4-ylmethyl)azepane-1-carboxamide
CID 110196376
2-(morpholin-4-ylmethyl)-N-propan-2-ylazepane-1-carboxamide
CID 110196377
2-(morpholin-4-ylmethyl)-N-propylazepane-1-carboxamide
CID 110196378

Frequently Asked Questions

What is the IUPAC name of N-cycloheptylmorpholine-4-carboxamide?
The IUPAC name of N-cycloheptylmorpholine-4-carboxamide (CID 669639) is N-cycloheptylmorpholine-4-carboxamide.
What is the SMILES notation for N-cycloheptylmorpholine-4-carboxamide?
The canonical SMILES for N-cycloheptylmorpholine-4-carboxamide is O=C(NC1CCCCCC1)N1CCOCC1.
What is the InChIKey of N-cycloheptylmorpholine-4-carboxamide?
The InChIKey is KUAQTBLFXCDWPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c15-12(14-7-9-16-10-8-14)13-11-5-3-1-2-4-6-11/h11H,1-10H2,(H,13,15).
What are the key properties of N-cycloheptylmorpholine-4-carboxamide?
N-cycloheptylmorpholine-4-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 1.75, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptylmorpholine-4-carboxamide is sourced from PubChem (CID 669639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).