3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide

C16H29N3O2 — CID 84592330

IUPAC3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide
SMILESCC(C)N(CCNC(=O)N1CCOCC1C1CC1)C1CC1
InChIInChI=1S/C16H29N3O2/c1-12(2)18(14-5-6-14)8-7-17-16(20)19-9-10-21-11-15(19)13-3-4-13/h12-15H,3-11H2,1-2H3,(H,17,20)
InChIKeyZMKLEXXVVRQEMN-UHFFFAOYSA-N
MW295.43 g/mol
LogP1.68
Rot. Bonds6

About 3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide

3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide (PubChem CID 84592330) has the molecular formula C16H29N3O2 and a molecular weight of 295.43 g/mol. Its IUPAC name is 3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide
PubChem CID84592330
Molecular FormulaC16H29N3O2
Molecular Weight295.43 g/mol
Exact Mass295.23
IUPAC Name3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide
SMILESCC(C)N(CCNC(=O)N1CCOCC1C1CC1)C1CC1
InChIInChI=1S/C16H29N3O2/c1-12(2)18(14-5-6-14)8-7-17-16(20)19-9-10-21-11-15(19)13-3-4-13/h12-15H,3-11H2,1-2H3,(H,17,20)
InChIKeyZMKLEXXVVRQEMN-UHFFFAOYSA-N
XLogP1.68
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-1-(3-cyclopropylmorpholin-4-yl)ethanone
CID 71757652
1-[2-[cyclopropyl(propan-2-yl)amino]ethyl]-3-(3-hydroxybutyl)urea
CID 111337403
(2S)-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]-2-methylsulfanylpropanamide
CID 97017596
(2R)-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]-2-methylsulfanylpropanamide
CID 97017595
(3R)-3-cyclopropyl-N-(1H-pyrazol-5-ylmethyl)morpholine-4-carboxamide
CID 97085480
2-[4-[3-[methyl(propan-2-yl)amino]propylcarbamoyl]morpholin-3-yl]acetic acid
CID 106039296
1-[2-[cyclopropyl(propan-2-yl)amino]ethyl]-2-methyl-3-(2-methyl-2-morpholin-4-ylpropyl)guanidine;hydroiodide
CID 111315911
1-[1-(cyclopropylmethyl)pyrrolidin-3-yl]-3-[2-[cyclopropyl(propan-2-yl)amino]ethyl]urea
CID 71932185
1-[2-[cyclopropyl(propan-2-yl)amino]ethyl]-3-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)urea
CID 75374803
(3S)-3-[(2R)-2-hydroxypropyl]-N-(3,3,3-trifluoropropyl)morpholine-4-carboxamide
CID 99855644
1-[2-[cyclopropyl(propan-2-yl)amino]ethyl]-3-ethyl-2-(2-methyl-2-morpholin-4-ylpropyl)guanidine
CID 111314970
3-[(3-methylmorpholine-4-carbonyl)amino]propanoic acid
CID 61209883

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide?
The IUPAC name of 3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide (CID 84592330) is 3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide.
What is the SMILES notation for 3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide?
The canonical SMILES for 3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide is CC(C)N(CCNC(=O)N1CCOCC1C1CC1)C1CC1.
What is the InChIKey of 3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide?
The InChIKey is ZMKLEXXVVRQEMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O2/c1-12(2)18(14-5-6-14)8-7-17-16(20)19-9-10-21-11-15(19)13-3-4-13/h12-15H,3-11H2,1-2H3,(H,17,20).
What are the key properties of 3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide?
3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide has a molecular weight of 295.43 g/mol, XLogP of 1.68, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[2-[cyclopropyl(propan-2-yl)amino]ethyl]morpholine-4-carboxamide is sourced from PubChem (CID 84592330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).