5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide

C9H18N6O — CID 82851846

IUPAC5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide
SMILESCC(N)CCCC(=O)NC(C)c1nn[nH]n1
InChIInChI=1S/C9H18N6O/c1-6(10)4-3-5-8(16)11-7(2)9-12-14-15-13-9/h6-7H,3-5,10H2,1-2H3,(H,11,16)(H,12,13,14,15)
InChIKeyRDWQNNIBACLAIR-UHFFFAOYSA-N
MW226.28 g/mol
LogP-0.11
Rot. Bonds6

About 5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide

5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide (PubChem CID 82851846) has the molecular formula C9H18N6O and a molecular weight of 226.28 g/mol. Its IUPAC name is 5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide.

Molecular Properties

Compound Name5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide
PubChem CID82851846
Molecular FormulaC9H18N6O
Molecular Weight226.28 g/mol
Exact Mass226.15
IUPAC Name5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide
SMILESCC(N)CCCC(=O)NC(C)c1nn[nH]n1
InChIInChI=1S/C9H18N6O/c1-6(10)4-3-5-8(16)11-7(2)9-12-14-15-13-9/h6-7H,3-5,10H2,1-2H3,(H,11,16)(H,12,13,14,15)
InChIKeyRDWQNNIBACLAIR-UHFFFAOYSA-N
XLogP-0.11
TPSA109.58 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 5-0.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5-hydroxy-N-[1-(2H-tetrazol-5-yl)ethyl]pentanamide
CID 79209401
N-[1-(2H-tetrazol-5-yl)ethyl]dodecanamide
CID 65426546
(2R)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide
CID 78977288
N-[1-(2H-tetrazol-5-yl)ethyl]but-3-enamide
CID 62679492
(2S)-2-amino-N-[1-(2H-tetrazol-5-yl)ethyl]pentanamide
CID 107569502
2-[(2-methylpropan-2-yl)oxy]-N-[1-(2H-tetrazol-5-yl)ethyl]acetamide
CID 112603262
3-pyrazol-1-yl-N-[1-(2H-tetrazol-5-yl)ethyl]propanamide
CID 60912135
2-(azetidin-3-yl)-N-[1-(2H-tetrazol-5-yl)ethyl]acetamide
CID 64612043
5-amino-N-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]hexanamide
CID 82847987
2-(4-chlorophenyl)-N-[1-(2H-tetrazol-5-yl)ethyl]acetamide
CID 60929808
N-[1-(2H-tetrazol-5-yl)ethyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 103209251
2,2,3,3-tetramethyl-N-[1-(2H-tetrazol-5-yl)ethyl]cyclopropane-1-carboxamide
CID 66477311

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide?
The IUPAC name of 5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide (CID 82851846) is 5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide.
What is the SMILES notation for 5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide?
The canonical SMILES for 5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide is CC(N)CCCC(=O)NC(C)c1nn[nH]n1.
What is the InChIKey of 5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide?
The InChIKey is RDWQNNIBACLAIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N6O/c1-6(10)4-3-5-8(16)11-7(2)9-12-14-15-13-9/h6-7H,3-5,10H2,1-2H3,(H,11,16)(H,12,13,14,15).
What are the key properties of 5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide?
5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide has a molecular weight of 226.28 g/mol, XLogP of -0.11, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[1-(2H-tetrazol-5-yl)ethyl]hexanamide is sourced from PubChem (CID 82851846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).