N-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide

C10H17N5O2 — CID 103548648

IUPACN-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide
SMILESO=C(CCn1ccnn1)NCC1COCCN1
InChIInChI=1S/C10H17N5O2/c16-10(1-4-15-5-2-13-14-15)12-7-9-8-17-6-3-11-9/h2,5,9,11H,1,3-4,6-8H2,(H,12,16)
InChIKeyXQUSWLAXNOPESA-UHFFFAOYSA-N
MW239.28 g/mol
LogP-1.23
Rot. Bonds5

About N-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide

N-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide (PubChem CID 103548648) has the molecular formula C10H17N5O2 and a molecular weight of 239.28 g/mol. Its IUPAC name is N-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide.

Molecular Properties

Compound NameN-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide
PubChem CID103548648
Molecular FormulaC10H17N5O2
Molecular Weight239.28 g/mol
Exact Mass239.14
IUPAC NameN-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide
SMILESO=C(CCn1ccnn1)NCC1COCCN1
InChIInChI=1S/C10H17N5O2/c16-10(1-4-15-5-2-13-14-15)12-7-9-8-17-6-3-11-9/h2,5,9,11H,1,3-4,6-8H2,(H,12,16)
InChIKeyXQUSWLAXNOPESA-UHFFFAOYSA-N
XLogP-1.23
TPSA81.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 5-1.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(morpholin-3-ylmethyl)-2-(triazol-1-yl)acetamide
CID 103548678
N-[(4-hydroxycyclohexyl)methyl]-3-(triazol-1-yl)propanamide
CID 114146390
N-(pyrrolidin-2-ylmethyl)-2-(triazol-1-yl)acetamide
CID 81478292
2-cyclopropyl-N-(morpholin-3-ylmethyl)acetamide
CID 103548657
4-[[3-(triazol-1-yl)propanoylamino]methyl]oxane-4-carboxylic acid
CID 115438215
N-(morpholin-3-ylmethyl)-4-phenylbutanamide
CID 103548407
N-(morpholin-3-ylmethyl)but-3-enamide
CID 103548351
morpholin-3-ylmethylurea
CID 103548775
2-methyl-N-[[(3S)-morpholin-3-yl]methyl]propanamide
CID 166764726
1-ethyl-3-(morpholin-3-ylmethyl)urea
CID 103548754
N-[2-(cycloheptylamino)ethyl]-3-(triazol-1-yl)propanamide
CID 81482627
2,2,3,3-tetramethyl-N-(morpholin-3-ylmethyl)cyclopropane-1-carboxamide
CID 103548670

Frequently Asked Questions

What is the IUPAC name of N-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide?
The IUPAC name of N-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide (CID 103548648) is N-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide.
What is the SMILES notation for N-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide?
The canonical SMILES for N-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide is O=C(CCn1ccnn1)NCC1COCCN1.
What is the InChIKey of N-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide?
The InChIKey is XQUSWLAXNOPESA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O2/c16-10(1-4-15-5-2-13-14-15)12-7-9-8-17-6-3-11-9/h2,5,9,11H,1,3-4,6-8H2,(H,12,16).
What are the key properties of N-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide?
N-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide has a molecular weight of 239.28 g/mol, XLogP of -1.23, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(morpholin-3-ylmethyl)-3-(triazol-1-yl)propanamide is sourced from PubChem (CID 103548648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).