N-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide

C10H19N5O — CID 151585517

IUPACN-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide
SMILESCCC(=O)N(CC)CCCc1nnnn1C
InChIInChI=1S/C10H19N5O/c1-4-10(16)15(5-2)8-6-7-9-11-12-13-14(9)3/h4-8H2,1-3H3
InChIKeyQHKGVDYUOPTCQP-UHFFFAOYSA-N
MW225.30 g/mol
LogP0.40
Rot. Bonds6

About N-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide

N-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide (PubChem CID 151585517) has the molecular formula C10H19N5O and a molecular weight of 225.30 g/mol. Its IUPAC name is N-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide.

Molecular Properties

Compound NameN-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide
PubChem CID151585517
Molecular FormulaC10H19N5O
Molecular Weight225.30 g/mol
Exact Mass225.16
IUPAC NameN-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide
SMILESCCC(=O)N(CC)CCCc1nnnn1C
InChIInChI=1S/C10H19N5O/c1-4-10(16)15(5-2)8-6-7-9-11-12-13-14(9)3/h4-8H2,1-3H3
InChIKeyQHKGVDYUOPTCQP-UHFFFAOYSA-N
XLogP0.40
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 50.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide?
The IUPAC name of N-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide (CID 151585517) is N-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide.
What is the SMILES notation for N-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide?
The canonical SMILES for N-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide is CCC(=O)N(CC)CCCc1nnnn1C.
What is the InChIKey of N-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide?
The InChIKey is QHKGVDYUOPTCQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O/c1-4-10(16)15(5-2)8-6-7-9-11-12-13-14(9)3/h4-8H2,1-3H3.
What are the key properties of N-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide?
N-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide has a molecular weight of 225.30 g/mol, XLogP of 0.40, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[3-(1-methyltetrazol-5-yl)propyl]propanamide is sourced from PubChem (CID 151585517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).