3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine

C12H17ClN2O — CID 103794745

IUPAC3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine
SMILESCOCCC1(CNc2ncccc2Cl)CC1
InChIInChI=1S/C12H17ClN2O/c1-16-8-6-12(4-5-12)9-15-11-10(13)3-2-7-14-11/h2-3,7H,4-6,8-9H2,1H3,(H,14,15)
InChIKeyHYIDTDWHGCOJKQ-UHFFFAOYSA-N
MW240.73 g/mol
LogP2.96
Rot. Bonds6

About 3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine

3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine (PubChem CID 103794745) has the molecular formula C12H17ClN2O and a molecular weight of 240.73 g/mol. Its IUPAC name is 3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine
PubChem CID103794745
Molecular FormulaC12H17ClN2O
Molecular Weight240.73 g/mol
Exact Mass240.10
IUPAC Name3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine
SMILESCOCCC1(CNc2ncccc2Cl)CC1
InChIInChI=1S/C12H17ClN2O/c1-16-8-6-12(4-5-12)9-15-11-10(13)3-2-7-14-11/h2-3,7H,4-6,8-9H2,1H3,(H,14,15)
InChIKeyHYIDTDWHGCOJKQ-UHFFFAOYSA-N
XLogP2.96
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.73
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-3-methylsulfonylpyridin-2-amine
CID 106544677
3-chloro-N-[(1-methylcyclopropyl)methyl]pyridin-2-amine
CID 103748441
3-[[1-(2-methoxyethyl)cyclopropyl]methylamino]pyrazine-2-carbonitrile
CID 103794641
3-[[1-(2-methoxyethyl)cyclopropyl]methylamino]pyrazine-2-carbothioamide
CID 114112950
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]thieno[3,2-c]pyridin-4-amine
CID 103794661
3-chloro-N-[(4-methyloxan-4-yl)methyl]pyridin-2-amine
CID 103748473
4-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-5-methylpyrimidine-4,6-diamine
CID 114113412
2-[(3-chloro-2-pyridinyl)amino]-N-(2-methoxyethyl)acetamide
CID 115575489
4-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-5-methylpyrimidine-2,4-diamine
CID 114113423
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyrido[2,3-b]pyrazin-6-amine
CID 103794776
2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol
CID 114755799
N-(3-chloro-2-pyridinyl)-3-methoxypropanamide
CID 75448204

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine?
The IUPAC name of 3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine (CID 103794745) is 3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine.
What is the SMILES notation for 3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine?
The canonical SMILES for 3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine is COCCC1(CNc2ncccc2Cl)CC1.
What is the InChIKey of 3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine?
The InChIKey is HYIDTDWHGCOJKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2O/c1-16-8-6-12(4-5-12)9-15-11-10(13)3-2-7-14-11/h2-3,7H,4-6,8-9H2,1H3,(H,14,15).
What are the key properties of 3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine?
3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine has a molecular weight of 240.73 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]pyridin-2-amine is sourced from PubChem (CID 103794745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).