N-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine

C10H19N5O — CID 103085524

IUPACN-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine
SMILESCCNC(C)c1nnnn1C1CCOCC1
InChIInChI=1S/C10H19N5O/c1-3-11-8(2)10-12-13-14-15(10)9-4-6-16-7-5-9/h8-9,11H,3-7H2,1-2H3
InChIKeyVSIRHLDKAVPNGS-UHFFFAOYSA-N
MW225.30 g/mol
LogP0.70
Rot. Bonds4

About N-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine

N-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine (PubChem CID 103085524) has the molecular formula C10H19N5O and a molecular weight of 225.30 g/mol. Its IUPAC name is N-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine
PubChem CID103085524
Molecular FormulaC10H19N5O
Molecular Weight225.30 g/mol
Exact Mass225.16
IUPAC NameN-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine
SMILESCCNC(C)c1nnnn1C1CCOCC1
InChIInChI=1S/C10H19N5O/c1-3-11-8(2)10-12-13-14-15(10)9-4-6-16-7-5-9/h8-9,11H,3-7H2,1-2H3
InChIKeyVSIRHLDKAVPNGS-UHFFFAOYSA-N
XLogP0.70
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethanamine
CID 103086857
N-[1-[1-(4-propylcyclohexyl)tetrazol-5-yl]ethyl]propan-1-amine
CID 103085850
1-(1-cyclopentyltetrazol-5-yl)-N-methylethanamine
CID 103085419
2-methyl-N-[1-[1-(1-oxothian-4-yl)tetrazol-5-yl]ethyl]propan-1-amine
CID 103086907
N-[1-[1-(3-methylcyclobutyl)tetrazol-5-yl]ethyl]propan-1-amine
CID 103086859
N-(2-methoxyethyl)-1-[1-(thian-4-yl)tetrazol-5-yl]ethanamine
CID 103087012
N-[[1-(oxolan-3-yl)tetrazol-5-yl]methyl]propan-2-amine
CID 80715224
N-methyl-1-[1-(oxan-4-yl)tetrazol-5-yl]methanamine
CID 62737642
N-[1-[1-(3-methylsulfanylcyclopentyl)tetrazol-5-yl]ethyl]propan-1-amine
CID 114122719
N-[1-(1-cyclopropyltetrazol-5-yl)ethyl]-2,2-dimethylbutanamide
CID 86807912
N-ethyl-1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)tetrazol-5-yl]ethanamine
CID 103085578
3-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]-1,1-dipropylurea
CID 124730383

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine?
The IUPAC name of N-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine (CID 103085524) is N-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine.
What is the SMILES notation for N-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine?
The canonical SMILES for N-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine is CCNC(C)c1nnnn1C1CCOCC1.
What is the InChIKey of N-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine?
The InChIKey is VSIRHLDKAVPNGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O/c1-3-11-8(2)10-12-13-14-15(10)9-4-6-16-7-5-9/h8-9,11H,3-7H2,1-2H3.
What are the key properties of N-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine?
N-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine has a molecular weight of 225.30 g/mol, XLogP of 0.70, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine is sourced from PubChem (CID 103085524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).