N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine

C10H17N5O — CID 115892141

IUPACN-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine
SMILESCC1OCCC1NCc1nnnn1C1CC1
InChIInChI=1S/C10H17N5O/c1-7-9(4-5-16-7)11-6-10-12-13-14-15(10)8-2-3-8/h7-9,11H,2-6H2,1H3
InChIKeyQEDVCGHZMMZJRP-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.28
Rot. Bonds4

About N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine

N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine (PubChem CID 115892141) has the molecular formula C10H17N5O and a molecular weight of 223.28 g/mol. Its IUPAC name is N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine.

Molecular Properties

Compound NameN-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine
PubChem CID115892141
Molecular FormulaC10H17N5O
Molecular Weight223.28 g/mol
Exact Mass223.14
IUPAC NameN-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine
SMILESCC1OCCC1NCc1nnnn1C1CC1
InChIInChI=1S/C10H17N5O/c1-7-9(4-5-16-7)11-6-10-12-13-14-15(10)8-2-3-8/h7-9,11H,2-6H2,1H3
InChIKeyQEDVCGHZMMZJRP-UHFFFAOYSA-N
XLogP0.28
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine?
The IUPAC name of N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine (CID 115892141) is N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine.
What is the SMILES notation for N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine?
The canonical SMILES for N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine is CC1OCCC1NCc1nnnn1C1CC1.
What is the InChIKey of N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine?
The InChIKey is QEDVCGHZMMZJRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O/c1-7-9(4-5-16-7)11-6-10-12-13-14-15(10)8-2-3-8/h7-9,11H,2-6H2,1H3.
What are the key properties of N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine?
N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine has a molecular weight of 223.28 g/mol, XLogP of 0.28, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopropyltetrazol-5-yl)methyl]-2-methyloxolan-3-amine is sourced from PubChem (CID 115892141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).