N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide

C13H25N3O2 — CID 113481318

IUPACN-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide
SMILESCC(CC1COCCN1)NCCNC(=O)C1CC1
InChIInChI=1S/C13H25N3O2/c1-10(8-12-9-18-7-6-15-12)14-4-5-16-13(17)11-2-3-11/h10-12,14-15H,2-9H2,1H3,(H,16,17)
InChIKeyPAXPZCGAWFLEOL-UHFFFAOYSA-N
MW255.36 g/mol
LogP-0.13
Rot. Bonds7

About N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide

N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide (PubChem CID 113481318) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide
PubChem CID113481318
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC NameN-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide
SMILESCC(CC1COCCN1)NCCNC(=O)C1CC1
InChIInChI=1S/C13H25N3O2/c1-10(8-12-9-18-7-6-15-12)14-4-5-16-13(17)11-2-3-11/h10-12,14-15H,2-9H2,1H3,(H,16,17)
InChIKeyPAXPZCGAWFLEOL-UHFFFAOYSA-N
XLogP-0.13
TPSA62.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine
CID 113461867
tert-butyl N-[4-(1-morpholin-3-ylpropan-2-ylamino)butan-2-yl]carbamate
CID 107246908
4-[(1-morpholin-3-ylpropan-2-ylamino)methyl]cyclohexan-1-ol
CID 106124715
N',N'-dimethyl-N-(1-morpholin-3-ylpropan-2-yl)butane-1,4-diamine
CID 113461930
1-morpholin-3-yl-N-(2-thiomorpholin-4-ylethyl)propan-2-amine
CID 114173708
tert-butyl N-methyl-N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]carbamate
CID 107244961
N-[2-(pentan-2-ylamino)ethyl]cyclopropanecarboxamide
CID 75525140
3-ethyl-1-(1-morpholin-3-ylpropan-2-ylamino)pentan-2-ol
CID 106284470
tert-butyl N-[1-(1-morpholin-3-ylpropan-2-ylamino)propan-2-yl]carbamate
CID 107247432
2-methyl-3-morpholin-3-ylpropanoic acid;hydrochloride
CID 90043742
3-(2-methylpropyl)morpholine
CID 20811826
2-methyl-N-[[(3S)-morpholin-3-yl]methyl]propanamide
CID 166764726

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide (CID 113481318) is N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide is CC(CC1COCCN1)NCCNC(=O)C1CC1.
What is the InChIKey of N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide?
The InChIKey is PAXPZCGAWFLEOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-10(8-12-9-18-7-6-15-12)14-4-5-16-13(17)11-2-3-11/h10-12,14-15H,2-9H2,1H3,(H,16,17).
What are the key properties of N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide?
N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide has a molecular weight of 255.36 g/mol, XLogP of -0.13, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide is sourced from PubChem (CID 113481318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).