N-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide

C15H16BrN3O3 — CID 132936300

IUPACN-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide
SMILESBr.NCC(=O)NCC(=O)NC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C15H15N3O3.BrH/c16-8-13(19)17-9-14(20)18-15(21)12-6-5-10-3-1-2-4-11(10)7-12;/h1-7H,8-9,16H2,(H,17,19)(H,18,20,21);1H
InChIKeyYWSBHVXPDWWLPP-UHFFFAOYSA-N
MW366.22 g/mol
LogP0.75
Rot. Bonds4

About N-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide

N-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide (PubChem CID 132936300) has the molecular formula C15H16BrN3O3 and a molecular weight of 366.22 g/mol. Its IUPAC name is N-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide.

Molecular Properties

Compound NameN-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide
PubChem CID132936300
Molecular FormulaC15H16BrN3O3
Molecular Weight366.22 g/mol
Exact Mass365.04
IUPAC NameN-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide
SMILESBr.NCC(=O)NCC(=O)NC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C15H15N3O3.BrH/c16-8-13(19)17-9-14(20)18-15(21)12-6-5-10-3-1-2-4-11(10)7-12;/h1-7H,8-9,16H2,(H,17,19)(H,18,20,21);1H
InChIKeyYWSBHVXPDWWLPP-UHFFFAOYSA-N
XLogP0.75
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.22
LogP ≤ 50.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 24691516
ethane;naphthalene-2-carbohydrazide
CID 91601372
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CID 119384874
N-[4-(naphthalene-2-carbonylamino)butyl]naphthalene-2-carboxamide
CID 101181857
N-[2-oxo-2-(2-phenylethylamino)ethyl]naphthalene-2-carboxamide
CID 27670981
N-(2-hydroxyethyl)naphthalene-2-carboxamide
CID 13288324
ethyl 2-(naphthalene-2-carbonylamino)acetate
CID 43007593
N-propylnaphthalene-2-carboxamide
CID 6624536
N-(2-hydroxybenzoyl)naphthalene-2-carboxamide
CID 57386028
N-[(E)-but-2-en-2-yl]naphthalene-2-carboxamide
CID 173494224
N-[N'-(naphthalene-2-carbonyl)carbamimidoyl]naphthalene-2-carboxamide
CID 58870305
N-[2-(2-ethylanilino)-2-oxoethyl]naphthalene-2-carboxamide
CID 8699030

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide?
The IUPAC name of N-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide (CID 132936300) is N-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide.
What is the SMILES notation for N-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide?
The canonical SMILES for N-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide is Br.NCC(=O)NCC(=O)NC(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide?
The InChIKey is YWSBHVXPDWWLPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3.BrH/c16-8-13(19)17-9-14(20)18-15(21)12-6-5-10-3-1-2-4-11(10)7-12;/h1-7H,8-9,16H2,(H,17,19)(H,18,20,21);1H.
What are the key properties of N-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide?
N-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide has a molecular weight of 366.22 g/mol, XLogP of 0.75, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-aminoacetyl)amino]acetyl]naphthalene-2-carboxamide;hydrobromide is sourced from PubChem (CID 132936300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).