CID 176569796

C19H25N4O — CID 176569796

IUPAC—
SMILESCCN(CC)C(=O)N[C@H]1C=C(C2=C3C=CN=C3C=C[CH]2)CN(C)C1
InChIInChI=1S/C19H25N4O/c1-4-23(5-2)19(24)21-15-11-14(12-22(3)13-15)16-7-6-8-18-17(16)9-10-20-18/h6-11,15H,4-5,12-13H2,1-3H3,(H,21,24)/t15-/m0/s1
InChIKeyCVWHZYZLFOHALG-HNNXBMFYSA-N
MW325.44 g/mol
LogP2.32
Rot. Bonds4

About CID 176569796

CID 176569796 (PubChem CID 176569796) has the molecular formula C19H25N4O and a molecular weight of 325.44 g/mol.

Molecular Properties

Compound NameCID 176569796
PubChem CID176569796
Molecular FormulaC19H25N4O
Molecular Weight325.44 g/mol
Exact Mass325.20
IUPAC Name—
SMILESCCN(CC)C(=O)N[C@H]1C=C(C2=C3C=CN=C3C=C[CH]2)CN(C)C1
InChIInChI=1S/C19H25N4O/c1-4-23(5-2)19(24)21-15-11-14(12-22(3)13-15)16-7-6-8-18-17(16)9-10-20-18/h6-11,15H,4-5,12-13H2,1-3H3,(H,21,24)/t15-/m0/s1
InChIKeyCVWHZYZLFOHALG-HNNXBMFYSA-N
XLogP2.32
TPSA47.94 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.44
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

CID 156727576
CID 156727576
1,1-diethyl-3-[(9S)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinolin-9-yl]urea
CID 12917881
methyl (6aR,9S)-9-(diethylcarbamoylamino)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-5-carboxylate
CID 70395871
N,N-diethyl-5-(4-methoxy-1H-indol-7-yl)-1-methyl-3,6-dihydro-2H-pyridine-3-carboxamide
CID 176977741
3-[(6aR,9R)-7-methyl-4-prop-2-ynyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinolin-9-yl]-1,1-diethylurea
CID 42630751
1-ethyl-3-(1-propylpyrrolidin-3-yl)-1-(2-pyrazol-1-ylethyl)urea
CID 131947082
1,1-diethyl-3-(thiolan-3-yl)urea
CID 103698014
3-(5-cyclopropyl-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-9-yl)-1,1-diethylurea
CID 129157321
4-[[[(1,3-dimethylpiperidin-4-yl)-methylcarbamoyl]amino]methyl]-N,N-diethylbenzamide
CID 136513710
2-[ethyl-[(1-methylpiperidin-3-yl)carbamoyl]amino]acetic acid
CID 61223104
3-[(3S)-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidin-3-yl]-1,1-diethylurea
CID 7552346
[(6aR,9S)-9-(diethylcarbamoylamino)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-5-yl]-diethyl-methylazanium
CID 54057581

Frequently Asked Questions

What is the IUPAC name of CID 176569796?
The IUPAC name of CID 176569796 (CID 176569796) is not available.
What is the SMILES notation for CID 176569796?
The canonical SMILES for CID 176569796 is CCN(CC)C(=O)N[C@H]1C=C(C2=C3C=CN=C3C=C[CH]2)CN(C)C1.
What is the InChIKey of CID 176569796?
The InChIKey is CVWHZYZLFOHALG-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H25N4O/c1-4-23(5-2)19(24)21-15-11-14(12-22(3)13-15)16-7-6-8-18-17(16)9-10-20-18/h6-11,15H,4-5,12-13H2,1-3H3,(H,21,24)/t15-/m0/s1.
What are the key properties of CID 176569796?
CID 176569796 has a molecular weight of 325.44 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 176569796 is sourced from PubChem (CID 176569796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).