N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine

C17H24N6O2 — CID 42943739

IUPACN-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine
SMILESc1ccc(-n2nnnc2NCC(C2CCOC2)N2CCOCC2)cc1
InChIInChI=1S/C17H24N6O2/c1-2-4-15(5-3-1)23-17(19-20-21-23)18-12-16(14-6-9-25-13-14)22-7-10-24-11-8-22/h1-5,14,16H,6-13H2,(H,18,19,21)
InChIKeyZEQVSLQUNHXVDG-UHFFFAOYSA-N
MW344.42 g/mol
LogP0.81
Rot. Bonds6

About N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine

N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine (PubChem CID 42943739) has the molecular formula C17H24N6O2 and a molecular weight of 344.42 g/mol. Its IUPAC name is N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine.

Molecular Properties

Compound NameN-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine
PubChem CID42943739
Molecular FormulaC17H24N6O2
Molecular Weight344.42 g/mol
Exact Mass344.20
IUPAC NameN-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine
SMILESc1ccc(-n2nnnc2NCC(C2CCOC2)N2CCOCC2)cc1
InChIInChI=1S/C17H24N6O2/c1-2-4-15(5-3-1)23-17(19-20-21-23)18-12-16(14-6-9-25-13-14)22-7-10-24-11-8-22/h1-5,14,16H,6-13H2,(H,18,19,21)
InChIKeyZEQVSLQUNHXVDG-UHFFFAOYSA-N
XLogP0.81
TPSA77.33 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

N-[[(3S)-oxolan-3-yl]methyl]-1-phenyltetrazol-5-amine
CID 93422505
3-ethyl-2-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinolin-4-amine
CID 97340056
1-(oxolan-3-yl)-N-[(1-phenyltetrazol-5-yl)methyl]ethanamine
CID 115714244
(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine
CID 124738760
2-morpholin-4-yl-2-(oxolan-3-yl)-N-[phenyl(pyridin-2-yl)methyl]ethanamine
CID 75449073
N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]-1-phenyltetrazol-5-amine
CID 9449726
N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-6-phenylimidazo[2,1-b][1,3,4]thiadiazol-2-amine
CID 25330357
(2S)-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]-2-phenylbutanamide
CID 94150246
N-[[(2S)-oxolan-2-yl]methyl]-1-phenyltetrazol-5-amine
CID 8001539
1-[cyclopropyl(phenyl)methyl]-3-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]urea
CID 55590697
N-[(2-aminocyclohexyl)methyl]-1-phenyltetrazol-5-amine
CID 64927678
2-methyl-1-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-3-(2-phenyl-2-pyrrolidin-1-ylethyl)guanidine;hydroiodide
CID 111326635

Frequently Asked Questions

What is the IUPAC name of N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine?
The IUPAC name of N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine (CID 42943739) is N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine.
What is the SMILES notation for N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine?
The canonical SMILES for N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine is c1ccc(-n2nnnc2NCC(C2CCOC2)N2CCOCC2)cc1.
What is the InChIKey of N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine?
The InChIKey is ZEQVSLQUNHXVDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6O2/c1-2-4-15(5-3-1)23-17(19-20-21-23)18-12-16(14-6-9-25-13-14)22-7-10-24-11-8-22/h1-5,14,16H,6-13H2,(H,18,19,21).
What are the key properties of N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine?
N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine has a molecular weight of 344.42 g/mol, XLogP of 0.81, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine is sourced from PubChem (CID 42943739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).