4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine

C16H28N6O — CID 124623713

IUPAC4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine
SMILESC[C@@H](c1nnnn1C1CC1)N1CCCC[C@@H]1CN1CCOCC1
InChIInChI=1S/C16H28N6O/c1-13(16-17-18-19-22(16)14-5-6-14)21-7-3-2-4-15(21)12-20-8-10-23-11-9-20/h13-15H,2-12H2,1H3/t13-,15+/m0/s1
InChIKeyGYZFSGQGVSNEGV-DZGCQCFKSA-N
MW320.44 g/mol
LogP1.26
Rot. Bonds5

About 4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine

4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine (PubChem CID 124623713) has the molecular formula C16H28N6O and a molecular weight of 320.44 g/mol. Its IUPAC name is 4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine
PubChem CID124623713
Molecular FormulaC16H28N6O
Molecular Weight320.44 g/mol
Exact Mass320.23
IUPAC Name4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine
SMILESC[C@@H](c1nnnn1C1CC1)N1CCCC[C@@H]1CN1CCOCC1
InChIInChI=1S/C16H28N6O/c1-13(16-17-18-19-22(16)14-5-6-14)21-7-3-2-4-15(21)12-20-8-10-23-11-9-20/h13-15H,2-12H2,1H3/t13-,15+/m0/s1
InChIKeyGYZFSGQGVSNEGV-DZGCQCFKSA-N
XLogP1.26
TPSA59.31 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 51.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine with MolForge

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Related Compounds

11-[1-(1-cyclohexyltetrazol-5-yl)ethyl]-3,8-dioxa-11-azaspiro[5.6]dodecane
CID 119034827
N-ethyl-1-[1-(oxan-4-yl)tetrazol-5-yl]ethanamine
CID 103085524
4-[[1-[(1-cyclopropyltetrazol-5-yl)methyl]piperidin-4-yl]methyl]morpholine
CID 47053718
1-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]-4-[[(2R)-oxan-2-yl]methoxy]piperidine
CID 124623738
1-[(1R)-1-(1-cyclohexyltetrazol-5-yl)-2-methylpropyl]azepane
CID 861340
1-(1-cyclopentyltetrazol-5-yl)-N-methylethanamine
CID 103085419
N-cyclohexyl-2-[4-[(1R)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperazin-1-yl]-N-methylacetamide
CID 129401911
4-[(1-piperidin-4-yltetrazol-5-yl)methyl]morpholine
CID 84759260
4-[(S)-(1-cyclopentyltetrazol-5-yl)-thiophen-2-ylmethyl]morpholine
CID 1438561
3-amino-2-methyl-1-[2-(morpholin-4-ylmethyl)piperidin-1-yl]butan-1-one;dihydrochloride
CID 120503674
3-amino-1-[2-(morpholin-4-ylmethyl)piperidin-1-yl]butan-1-one;dihydrochloride
CID 119875389
1-(1-cyclohexyltetrazol-5-yl)butan-1-ol
CID 121220708

Frequently Asked Questions

What is the IUPAC name of 4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine?
The IUPAC name of 4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine (CID 124623713) is 4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine.
What is the SMILES notation for 4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine?
The canonical SMILES for 4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine is C[C@@H](c1nnnn1C1CC1)N1CCCC[C@@H]1CN1CCOCC1.
What is the InChIKey of 4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine?
The InChIKey is GYZFSGQGVSNEGV-DZGCQCFKSA-N. The full InChI is InChI=1S/C16H28N6O/c1-13(16-17-18-19-22(16)14-5-6-14)21-7-3-2-4-15(21)12-20-8-10-23-11-9-20/h13-15H,2-12H2,1H3/t13-,15+/m0/s1.
What are the key properties of 4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine?
4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine has a molecular weight of 320.44 g/mol, XLogP of 1.26, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(2R)-1-[(1S)-1-(1-cyclopropyltetrazol-5-yl)ethyl]piperidin-2-yl]methyl]morpholine is sourced from PubChem (CID 124623713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).