N-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide

C15H24N4O2 — CID 119665299

IUPACN-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide
SMILESCCCCC(CN)NC(=O)c1ccc(CNC(N)=O)cc1
InChIInChI=1S/C15H24N4O2/c1-2-3-4-13(9-16)19-14(20)12-7-5-11(6-8-12)10-18-15(17)21/h5-8,13H,2-4,9-10,16H2,1H3,(H,19,20)(H3,17,18,21)
InChIKeyFWVRCXWQYUNGJS-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.10
Rot. Bonds8

About N-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide

N-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide (PubChem CID 119665299) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide.

Molecular Properties

Compound NameN-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide
PubChem CID119665299
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide
SMILESCCCCC(CN)NC(=O)c1ccc(CNC(N)=O)cc1
InChIInChI=1S/C15H24N4O2/c1-2-3-4-13(9-16)19-14(20)12-7-5-11(6-8-12)10-18-15(17)21/h5-8,13H,2-4,9-10,16H2,1H3,(H,19,20)(H3,17,18,21)
InChIKeyFWVRCXWQYUNGJS-UHFFFAOYSA-N
XLogP1.10
TPSA110.24 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.10
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-aminohexan-2-yl)-4-(difluoromethylsulfanyl)benzamide;hydrochloride
CID 119666969
3-N-(1-aminohexan-2-yl)benzene-1,3-dicarboxamide;hydrochloride
CID 119667555
N-(1-aminohexan-2-yl)-3,5-dimethylbenzamide
CID 80697654
4-[(carbamoylamino)methyl]-N-[(2R)-1-hydroxypropan-2-yl]benzamide
CID 79027939
methyl 2-[[4-[(carbamoylamino)methyl]benzoyl]amino]propanoate
CID 60669043
N-(1-aminohexan-2-yl)-4-chloro-3-methylbenzamide
CID 113265964
4-[(carbamoylamino)methyl]-N-methylbenzamide
CID 39969427
N-(1-aminohexan-2-yl)-2,3-dihydro-1H-indene-5-carboxamide
CID 80697948
N-(1-aminohexan-2-yl)-4-(cyclopropanecarbonylamino)benzamide;hydrochloride
CID 119668361
3-N-(1-aminohexan-2-yl)-1-N-methylbenzene-1,3-dicarboxamide;hydrochloride
CID 119668834
N-(1-aminohexan-2-yl)-3-methylbenzamide;hydrochloride
CID 119667380
N-(1-aminohexan-2-yl)-3-bromo-4-fluorobenzamide;hydrochloride
CID 119668140

Frequently Asked Questions

What is the IUPAC name of N-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide?
The IUPAC name of N-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide (CID 119665299) is N-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide.
What is the SMILES notation for N-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide?
The canonical SMILES for N-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide is CCCCC(CN)NC(=O)c1ccc(CNC(N)=O)cc1.
What is the InChIKey of N-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide?
The InChIKey is FWVRCXWQYUNGJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-2-3-4-13(9-16)19-14(20)12-7-5-11(6-8-12)10-18-15(17)21/h5-8,13H,2-4,9-10,16H2,1H3,(H,19,20)(H3,17,18,21).
What are the key properties of N-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide?
N-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide has a molecular weight of 292.38 g/mol, XLogP of 1.10, 8 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminohexan-2-yl)-4-[(carbamoylamino)methyl]benzamide is sourced from PubChem (CID 119665299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).