3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide

C13H27N3O2 — CID 55098146

IUPAC3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCNC(C)CN1CCOCC1
InChIInChI=1S/C13H27N3O2/c1-11(2)15-13(17)4-5-14-12(3)10-16-6-8-18-9-7-16/h11-12,14H,4-10H2,1-3H3,(H,15,17)
InChIKeyRLXFTOUFWLPWFI-UHFFFAOYSA-N
MW257.38 g/mol
LogP0.21
Rot. Bonds7

About 3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide

3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide (PubChem CID 55098146) has the molecular formula C13H27N3O2 and a molecular weight of 257.38 g/mol. Its IUPAC name is 3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide
PubChem CID55098146
Molecular FormulaC13H27N3O2
Molecular Weight257.38 g/mol
Exact Mass257.21
IUPAC Name3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCNC(C)CN1CCOCC1
InChIInChI=1S/C13H27N3O2/c1-11(2)15-13(17)4-5-14-12(3)10-16-6-8-18-9-7-16/h11-12,14H,4-10H2,1-3H3,(H,15,17)
InChIKeyRLXFTOUFWLPWFI-UHFFFAOYSA-N
XLogP0.21
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-hydroxy-N-(1-morpholin-4-ylpropan-2-yl)butanamide
CID 79201322
N-[2-(1-morpholin-4-ylpropan-2-ylamino)ethyl]acetamide
CID 107529281
4-hydroxy-N-(1-morpholin-4-ylpropan-2-yl)pentanamide
CID 79201323
N-methyl-3-(1-pyrrolidin-1-ylpropan-2-ylamino)propanamide
CID 62324218
1-(1,4-oxazepan-4-yl)-N-propylpropan-2-amine
CID 62988157
3-amino-N-(1-morpholin-4-ylpropan-2-yl)propanamide;dihydrochloride
CID 119851619
N-(1-morpholin-4-ylpropan-2-yl)butan-1-amine
CID 43675929
N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine
CID 80694695
1-morpholin-4-yl-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine
CID 54965105
2-(1-aminocyclobutyl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide
CID 79852064
N-(3-fluoropropyl)-1-morpholin-4-ylpropan-2-amine
CID 81105734
(2R)-1-(1-morpholin-4-ylpropan-2-ylamino)propan-2-ol
CID 106931969

Frequently Asked Questions

What is the IUPAC name of 3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide?
The IUPAC name of 3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide (CID 55098146) is 3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide?
The canonical SMILES for 3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide is CC(C)NC(=O)CCNC(C)CN1CCOCC1.
What is the InChIKey of 3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide?
The InChIKey is RLXFTOUFWLPWFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O2/c1-11(2)15-13(17)4-5-14-12(3)10-16-6-8-18-9-7-16/h11-12,14H,4-10H2,1-3H3,(H,15,17).
What are the key properties of 3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide?
3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide has a molecular weight of 257.38 g/mol, XLogP of 0.21, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-morpholin-4-ylpropan-2-ylamino)-N-propan-2-ylpropanamide is sourced from PubChem (CID 55098146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).