N-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine

C9H18N6 — CID 106633822

IUPACN-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine
SMILESCC(NCC1CCCCN1)c1nn[nH]n1
InChIInChI=1S/C9H18N6/c1-7(9-12-14-15-13-9)11-6-8-4-2-3-5-10-8/h7-8,10-11H,2-6H2,1H3,(H,12,13,14,15)
InChIKeyVZHQMXYTAGNICP-UHFFFAOYSA-N
MW210.28 g/mol
LogP-0.01
Rot. Bonds4

About N-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine

N-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine (PubChem CID 106633822) has the molecular formula C9H18N6 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine.

Molecular Properties

Compound NameN-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine
PubChem CID106633822
Molecular FormulaC9H18N6
Molecular Weight210.28 g/mol
Exact Mass210.16
IUPAC NameN-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine
SMILESCC(NCC1CCCCN1)c1nn[nH]n1
InChIInChI=1S/C9H18N6/c1-7(9-12-14-15-13-9)11-6-8-4-2-3-5-10-8/h7-8,10-11H,2-6H2,1H3,(H,12,13,14,15)
InChIKeyVZHQMXYTAGNICP-UHFFFAOYSA-N
XLogP-0.01
TPSA78.52 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 5-0.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine
CID 59332807
N-(piperidin-2-ylmethyl)-1-pyrazin-2-ylethanamine
CID 71637820
N-(piperidin-2-ylmethyl)-1-(4-propan-2-ylphenyl)ethanamine
CID 106633350
(1S)-1-(4-fluorophenyl)-N-(piperidin-2-ylmethyl)ethanamine
CID 106634173
1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine
CID 54963110
N-(azepan-2-ylmethyl)-1-(2,4-dimethyl-1,3-thiazol-5-yl)ethanamine
CID 64569173
2-(2H-tetrazol-5-ylmethyl)piperidine
CID 84652779
(1S)-1-(4-methoxyphenyl)-N-(piperidin-2-ylmethyl)ethanamine
CID 106634175
3-(piperidin-2-ylmethylamino)butanamide
CID 106634453
4-methyl-N-(piperidin-2-ylmethyl)hexan-2-amine
CID 106634056
N-(piperidin-2-ylmethyl)hexan-2-amine
CID 62199509
N-methyl-1-(2H-tetrazol-5-yl)ethanamine
CID 50988513

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine?
The IUPAC name of N-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine (CID 106633822) is N-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine.
What is the SMILES notation for N-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine?
The canonical SMILES for N-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine is CC(NCC1CCCCN1)c1nn[nH]n1.
What is the InChIKey of N-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine?
The InChIKey is VZHQMXYTAGNICP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N6/c1-7(9-12-14-15-13-9)11-6-8-4-2-3-5-10-8/h7-8,10-11H,2-6H2,1H3,(H,12,13,14,15).
What are the key properties of N-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine?
N-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine has a molecular weight of 210.28 g/mol, XLogP of -0.01, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-2-ylmethyl)-1-(2H-tetrazol-5-yl)ethanamine is sourced from PubChem (CID 106633822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).