N-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide

C14H25N5O — CID 3061972

IUPACN-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide
SMILESCCN(C(=O)CCCn1nnnc1C)C1CCCCC1
InChIInChI=1S/C14H25N5O/c1-3-18(13-8-5-4-6-9-13)14(20)10-7-11-19-12(2)15-16-17-19/h13H,3-11H2,1-2H3
InChIKeyGNNJQTRYMSDETQ-UHFFFAOYSA-N
MW279.39 g/mol
LogP1.94
Rot. Bonds6

About N-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide

N-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide (PubChem CID 3061972) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is N-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide.

Molecular Properties

Compound NameN-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide
PubChem CID3061972
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC NameN-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide
SMILESCCN(C(=O)CCCn1nnnc1C)C1CCCCC1
InChIInChI=1S/C14H25N5O/c1-3-18(13-8-5-4-6-9-13)14(20)10-7-11-19-12(2)15-16-17-19/h13H,3-11H2,1-2H3
InChIKeyGNNJQTRYMSDETQ-UHFFFAOYSA-N
XLogP1.94
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1H-Tetrazole-1-butanamide, N,N-diethyl-5-methyl-
CID 3061971
N-((1-cyclohexyl-1H-tetrazol-5-yl)methyl)isobutyramide
CID 41568266
1-(1-Cyclohexyltetrazol-5-yl)propan-2-one
CID 134976072
N-((1-cyclohexyl-1H-tetrazol-5-yl)methyl)acetamide
CID 41568262
N-((1-cyclohexyl-1H-tetrazol-5-yl)methyl)propionamide
CID 41568263
N-((1-cyclohexyl-1H-tetrazol-5-yl)methyl)butyramide
CID 41568264
N-((1-cyclohexyl-1H-tetrazol-5-yl)methyl)-3-methylbutanamide
CID 41568273
4-(5-methyltetrazol-1-yl)-N,N-dipropylbutanamide
CID 13103342
N,N-dibutyl-4-(5-methyltetrazol-1-yl)butanamide
CID 13103343
N-hexyl-4-(5-methyltetrazol-1-yl)butanamide
CID 13103344
N-cyclohexyl-N-(2-hydroxyethyl)-4-(5-methyltetrazol-1-yl)butanamide
CID 13103349
4-(5-Methyltetrazol-1-yl)-1-piperidin-1-ylbutan-1-one
CID 13103358

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide?
The IUPAC name of N-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide (CID 3061972) is N-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide.
What is the SMILES notation for N-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide?
The canonical SMILES for N-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide is CCN(C(=O)CCCn1nnnc1C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide?
The InChIKey is GNNJQTRYMSDETQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-3-18(13-8-5-4-6-9-13)14(20)10-7-11-19-12(2)15-16-17-19/h13H,3-11H2,1-2H3.
What are the key properties of N-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide?
N-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide has a molecular weight of 279.39 g/mol, XLogP of 1.94, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-ethyl-4-(5-methyltetrazol-1-yl)butanamide is sourced from PubChem (CID 3061972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).