3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine

C12H18IN3O — CID 75373063

IUPAC3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
SMILESCC(CN1CCOCC1)Nc1ncccc1I
InChIInChI=1S/C12H18IN3O/c1-10(9-16-5-7-17-8-6-16)15-12-11(13)3-2-4-14-12/h2-4,10H,5-9H2,1H3,(H,14,15)
InChIKeyJWMUYBOIMZEVAV-UHFFFAOYSA-N
MW347.20 g/mol
LogP1.82
Rot. Bonds4

About 3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine

3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine (PubChem CID 75373063) has the molecular formula C12H18IN3O and a molecular weight of 347.20 g/mol. Its IUPAC name is 3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
PubChem CID75373063
Molecular FormulaC12H18IN3O
Molecular Weight347.20 g/mol
Exact Mass347.05
IUPAC Name3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
SMILESCC(CN1CCOCC1)Nc1ncccc1I
InChIInChI=1S/C12H18IN3O/c1-10(9-16-5-7-17-8-6-16)15-12-11(13)3-2-4-14-12/h2-4,10H,5-9H2,1H3,(H,14,15)
InChIKeyJWMUYBOIMZEVAV-UHFFFAOYSA-N
XLogP1.82
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.20
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

3-fluoro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 62733426
2-(methylamino)-N-(1-morpholin-4-ylpropan-2-yl)pyridine-3-sulfonamide
CID 62151364
1-(1-morpholin-4-ylpropan-2-ylamino)isoquinolin-7-ol
CID 106538109
1-morpholin-4-yl-N-(pyrimidin-2-ylmethyl)propan-2-amine
CID 62699740
1-(3-methyl-2-pyridinyl)-3-[(2S)-1-morpholin-4-ylpropan-2-yl]urea
CID 94102902
N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyrimidin-4-amine
CID 94220826
2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-4-amine
CID 79633115
2-chloro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-4-amine
CID 103721807
5-ethyl-6-N-methyl-4-N-(1-morpholin-4-ylpropan-2-yl)pyrimidine-4,6-diamine
CID 80802012
2-amino-N-(1-morpholin-4-ylpropan-2-yl)pyridine-3-sulfonamide
CID 62151539
6-chloro-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine
CID 63586349
4-methoxy-N-(1-morpholin-4-ylpropan-2-yl)pyrimidin-2-amine
CID 112685180

Frequently Asked Questions

What is the IUPAC name of 3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine?
The IUPAC name of 3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine (CID 75373063) is 3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine.
What is the SMILES notation for 3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine?
The canonical SMILES for 3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine is CC(CN1CCOCC1)Nc1ncccc1I.
What is the InChIKey of 3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine?
The InChIKey is JWMUYBOIMZEVAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18IN3O/c1-10(9-16-5-7-17-8-6-16)15-12-11(13)3-2-4-14-12/h2-4,10H,5-9H2,1H3,(H,14,15).
What are the key properties of 3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine?
3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine has a molecular weight of 347.20 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-iodo-N-(1-morpholin-4-ylpropan-2-yl)pyridin-2-amine is sourced from PubChem (CID 75373063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).