2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide

C17H26N2O — CID 60937239

IUPAC2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide
SMILESCCCC(C)(N)C(=O)N(C)C1CCCc2ccccc21
InChIInChI=1S/C17H26N2O/c1-4-12-17(2,18)16(20)19(3)15-11-7-9-13-8-5-6-10-14(13)15/h5-6,8,10,15H,4,7,9,11-12,18H2,1-3H3
InChIKeyMRFUZCIDIDYBKR-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.04
Rot. Bonds4

About 2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide

2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide (PubChem CID 60937239) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide.

Molecular Properties

Compound Name2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide
PubChem CID60937239
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide
SMILESCCCC(C)(N)C(=O)N(C)C1CCCc2ccccc21
InChIInChI=1S/C17H26N2O/c1-4-12-17(2,18)16(20)19(3)15-11-7-9-13-8-5-6-10-14(13)15/h5-6,8,10,15H,4,7,9,11-12,18H2,1-3H3
InChIKeyMRFUZCIDIDYBKR-UHFFFAOYSA-N
XLogP3.04
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide?
The IUPAC name of 2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide (CID 60937239) is 2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide.
What is the SMILES notation for 2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide?
The canonical SMILES for 2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide is CCCC(C)(N)C(=O)N(C)C1CCCc2ccccc21.
What is the InChIKey of 2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide?
The InChIKey is MRFUZCIDIDYBKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-4-12-17(2,18)16(20)19(3)15-11-7-9-13-8-5-6-10-14(13)15/h5-6,8,10,15H,4,7,9,11-12,18H2,1-3H3.
What are the key properties of 2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide?
2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide has a molecular weight of 274.41 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide is sourced from PubChem (CID 60937239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).